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Chemical Name
Cas Number
EINECS Number
MDL Number
Molecular Formula
InChIKey
Smiles
Journal Title
GO
Journal of the American Chemical Society - 6338 compounds - page 5
oxacyclononadecan-2-one
Molecular Formula:
C
18
H
34
O
2
Molecular Weight:
282.467 g/mol
Cas Number:
-
EINECS Number:
-
ethyl (2Z,5Z)-3-methoxy-2,5-heptadienoate
Molecular Formula:
C
10
H
16
O
3
Molecular Weight:
184.235 g/mol
Cas Number:
-
EINECS Number:
-
methyl (2Z,5Z)-3-methoxy-2,5-heptadienoate
Molecular Formula:
C
9
H
14
O
3
Molecular Weight:
170.208 g/mol
Cas Number:
-
EINECS Number:
-
(2E,6E)-8-(4-methoxyphenyl)-3,7-dimethyl-2,6-octadienal
Molecular Formula:
C
17
H
22
O
2
Molecular Weight:
258.36 g/mol
Cas Number:
-
EINECS Number:
-
3-methylolbenzaldehyde
Molecular Formula:
C
8
H
8
O
2
Molecular Weight:
136.15 g/mol
Cas Number:
52010-98-7
EINECS Number:
-
3-oxo-1-cyclohexene-1-carbaldehyde
Molecular Formula:
C
7
H
8
O
2
Molecular Weight:
124.139 g/mol
Cas Number:
-
EINECS Number:
-
2-cyclohexene-1-carbaldehyde
Molecular Formula:
C
7
H
10
O
Molecular Weight:
110.156 g/mol
Cas Number:
-
EINECS Number:
-
ethyl (2Z)-3-methoxy-5-oxo-2-pentenoate
Molecular Formula:
C
8
H
12
O
4
Molecular Weight:
172.181 g/mol
Cas Number:
-
EINECS Number:
-
N-benzyl-4-ethyl-2-methylaniline
Molecular Formula:
C
16
H
19
N
Molecular Weight:
225.334 g/mol
Cas Number:
-
EINECS Number:
-
1,6-diphenyl-1,6-hexanedione
Molecular Formula:
C
18
H
18
O
2
Molecular Weight:
266.34 g/mol
Cas Number:
3375-38-0
EINECS Number:
222-166-5
4-oxoundecanal
Molecular Formula:
C
11
H
20
O
2
Molecular Weight:
184.279 g/mol
Cas Number:
-
EINECS Number:
-
3-methyl-4-oxoundecanal
Molecular Formula:
C
12
H
22
O
2
Molecular Weight:
198.305 g/mol
Cas Number:
-
EINECS Number:
-
1-benzyl-3-methyl-3-phenylsulfanylazetidin-2-one
Molecular Formula:
C
17
H
17
NOS
Molecular Weight:
283.394 g/mol
Cas Number:
-
EINECS Number:
-
4,4,6-trimethyl-2,3,3a,5-tetrahydro-pentalen-1-one
Molecular Formula:
C
11
H
16
O
Molecular Weight:
164.247 g/mol
Cas Number:
-
EINECS Number:
-
3-chloro-4,5,6,6a-tetrahydro-1H-pentalen-2-one
Molecular Formula:
C
8
H
9
ClO
Molecular Weight:
156.612 g/mol
Cas Number:
-
EINECS Number:
-
4-chloro-1,3-dioxolan-2-one
Molecular Formula:
C
3
H
3
ClO
3
Molecular Weight:
122.508 g/mol
Cas Number:
3967-54-2
EINECS Number:
223-583-5
crinan-3-one
Molecular Formula:
C
16
H
17
NO
3
Molecular Weight:
271.316 g/mol
Cas Number:
-
EINECS Number:
-
3-(1,3-benzodioxol-5-yl)-4-nitrobutanenitrile
Molecular Formula:
C
11
H
10
N
2
O
4
Molecular Weight:
234.211 g/mol
Cas Number:
-
EINECS Number:
-
3-(1,3-benzodioxol-5-yl)-4,4-dimethoxybutanenitrile
Molecular Formula:
C
13
H
15
NO
4
Molecular Weight:
249.266 g/mol
Cas Number:
-
EINECS Number:
-
2,8-dimethyl-1,1'-biphenyl
Molecular Formula:
C
16
H
16
Molecular Weight:
208.303 g/mol
Cas Number:
-
EINECS Number:
-
2,3-dimethyl-1,1'-biphenyl
Molecular Formula:
C
16
H
16
Molecular Weight:
208.303 g/mol
Cas Number:
-
EINECS Number:
-
1,2,4,7,8,8a-hexahydro-indolizin-3-one
Molecular Formula:
C
8
H
11
NO
Molecular Weight:
137.181 g/mol
Cas Number:
-
EINECS Number:
-
1-(phenylsulfonyl)-2-pyrrolidinone
Molecular Formula:
C
10
H
11
NO
3
S
Molecular Weight:
225.268 g/mol
Cas Number:
-
EINECS Number:
-
tert-butyl benzoylcarbamate
Molecular Formula:
C
12
H
15
NO
3
Molecular Weight:
221.256 g/mol
Cas Number:
-
EINECS Number:
-
2-(2-hydroxy-3-oxocyclohexyl)-1H-isoindole-1,3(2H)-dione
Molecular Formula:
C
14
H
13
NO
4
Molecular Weight:
259.262 g/mol
Cas Number:
-
EINECS Number:
-
dimethyl 2-(1-phenyl-2-propenyl)malonate
Molecular Formula:
C
14
H
16
O
4
Molecular Weight:
248.279 g/mol
Cas Number:
-
EINECS Number:
-
dimethyl 2-allylmalonate
Molecular Formula:
C
8
H
12
O
4
Molecular Weight:
172.181 g/mol
Cas Number:
40637-56-7
EINECS Number:
255-017-8
3-phenyl-1-oxaspiro[3.5]nonan-2-one
Molecular Formula:
C
14
H
16
O
2
Molecular Weight:
216.28 g/mol
Cas Number:
7465-32-9
EINECS Number:
-
(2E)-2,3-diphenyl-2-propenoic acid
Molecular Formula:
C
15
H
12
O
2
Molecular Weight:
224.259 g/mol
Cas Number:
91-48-5
EINECS Number:
202-069-4
2-(3,4-dimethoxy-2-phenylmethoxyphenyl)oxirane
Molecular Formula:
C
17
H
18
O
4
Molecular Weight:
286.328 g/mol
Cas Number:
-
EINECS Number:
-
(3E)-2-ethyl-3-penten-1-ol
Molecular Formula:
C
7
H
14
O
Molecular Weight:
114.188 g/mol
Cas Number:
-
EINECS Number:
-
bicyclo[3.2.0]hept-6-ylmethanol
Molecular Formula:
C
8
H
14
O
Molecular Weight:
126.199 g/mol
Cas Number:
-
EINECS Number:
-
bicyclo[3.2.0]hept-1-ylmethanol
Molecular Formula:
C
8
H
14
O
Molecular Weight:
126.199 g/mol
Cas Number:
-
EINECS Number:
-
(2E)-6-(benzyloxy)-2-hexanone dimethylhydrazone
Molecular Formula:
C
15
H
24
N
2
O
Molecular Weight:
248.368 g/mol
Cas Number:
-
EINECS Number:
-
methyl 6-oxo-1,6-dihydro-3-pyridinecarboxylate
Molecular Formula:
C
7
H
7
NO
3
Molecular Weight:
153.138 g/mol
Cas Number:
66171-50-4
EINECS Number:
-
4,6-ditert-butyl-2H-pyran-2-one
Molecular Formula:
C
13
H
20
O
2
Molecular Weight:
208.301 g/mol
Cas Number:
-
EINECS Number:
-
5-ethoxy-3,6-dihydro-2H-thiopyran-2-carbonitrile
Molecular Formula:
C
8
H
11
NOS
Molecular Weight:
169.247 g/mol
Cas Number:
-
EINECS Number:
-
diethyl carbonate
Molecular Formula:
C
5
H
10
O
3
Molecular Weight:
118.133 g/mol
Cas Number:
105-58-8
EINECS Number:
203-311-1
3-tert-butyl-1,5-pentanediol
Molecular Formula:
C
9
H
20
O
2
Molecular Weight:
160.257 g/mol
Cas Number:
-
EINECS Number:
-
1-phenyl-2-(2,2,6,6-tetramethylcyclohexylidene)ethanone
Molecular Formula:
C
18
H
24
O
Molecular Weight:
256.388 g/mol
Cas Number:
-
EINECS Number:
-
5-methyl-7-methylenebicyclo[3.2.1]oct-3-en-2-one
Molecular Formula:
C
10
H
12
O
Molecular Weight:
148.205 g/mol
Cas Number:
-
EINECS Number:
-
ethyl 9-oxobicyclo[3.3.1]non-3-ene-1-carboxylate
Molecular Formula:
C
12
H
16
O
3
Molecular Weight:
208.257 g/mol
Cas Number:
-
EINECS Number:
-
2-phenyl-2-heptanol
Molecular Formula:
C
13
H
20
O
Molecular Weight:
192.301 g/mol
Cas Number:
-
EINECS Number:
-
4-isopropyl-1,3-dimethyl-2-cyclohexen-1-ol
Molecular Formula:
C
11
H
20
O
Molecular Weight:
168.279 g/mol
Cas Number:
-
EINECS Number:
-
1,1-difluoro-2-vinylcyclopropane
Molecular Formula:
C
5
H
6
F
2
Molecular Weight:
104.099 g/mol
Cas Number:
694-34-8
EINECS Number:
-
4-methyl-2-cyclopenten-1-one
Molecular Formula:
C
6
H
8
O
Molecular Weight:
96.129 g/mol
Cas Number:
-
EINECS Number:
-
1-phenylsulfanyl-but-3-en-2-ol
Molecular Formula:
C
10
H
12
OS
Molecular Weight:
180.271 g/mol
Cas Number:
-
EINECS Number:
-
1-phenylethanethione
Molecular Formula:
C
8
H
8
S
Molecular Weight:
136.218 g/mol
Cas Number:
16696-68-7
EINECS Number:
-
2,2-dimethylpropanethial
Molecular Formula:
C
5
H
10
S
Molecular Weight:
102.2 g/mol
Cas Number:
-
EINECS Number:
-
3-methyl-1,4-diphenyl-2-azetidinethione
Molecular Formula:
C
16
H
15
NS
Molecular Weight:
253.368 g/mol
Cas Number:
-
EINECS Number:
-
2,3-dibutylaziridine
Molecular Formula:
C
10
H
21
N
Molecular Weight:
155.283 g/mol
Cas Number:
-
EINECS Number:
-
dimethyl 2-(1-cyclopenten-1-ylmethyl)malonate
Molecular Formula:
C
11
H
16
O
4
Molecular Weight:
212.246 g/mol
Cas Number:
-
EINECS Number:
-
N-benzyl(1-cyclopenten-1-yl)methanamine
Molecular Formula:
C
13
H
17
N
Molecular Weight:
187.285 g/mol
Cas Number:
-
EINECS Number:
-
methyl (3Z,5E)-6-(acetyloxy)-3,5-heptadienoate
Molecular Formula:
C
10
H
14
O
4
Molecular Weight:
198.219 g/mol
Cas Number:
-
EINECS Number:
-
methyl (4E)-6-oxo-4-heptenoate
Molecular Formula:
C
8
H
12
O
3
Molecular Weight:
156.181 g/mol
Cas Number:
-
EINECS Number:
-
4a,8,8-trimethyl-4,5,6,7-tetrahydro-3H-naphthalen-2-one
Molecular Formula:
C
13
H
20
O
Molecular Weight:
192.301 g/mol
Cas Number:
-
EINECS Number:
-
1-(3,4-dimethylenecyclohexyl)ethanone
Molecular Formula:
C
10
H
14
O
Molecular Weight:
150.221 g/mol
Cas Number:
-
EINECS Number:
-
ethyl 2-methyl-1,3-thiazole-5-carboxylate
Molecular Formula:
C
7
H
9
NO
2
S
Molecular Weight:
171.22 g/mol
Cas Number:
79836-78-5
EINECS Number:
-
5-(bromomethyl)-2-methyl-1,3-oxazole
Molecular Formula:
C
5
H
6
BrNO
Molecular Weight:
176.013 g/mol
Cas Number:
-
EINECS Number:
-
2-chloro-1-methyl-4-nitrobenzene
Molecular Formula:
C
7
H
6
ClNO
2
Molecular Weight:
171.583 g/mol
Cas Number:
121-86-8
EINECS Number:
204-501-7
5-formyl-2-methoxy-4-methylbenzamide
Molecular Formula:
C
10
H
11
NO
3
Molecular Weight:
193.202 g/mol
Cas Number:
-
EINECS Number:
-
diethyl 2-[(2E)-5-oxo-2-hexenyl]malonate
Molecular Formula:
C
13
H
20
O
5
Molecular Weight:
256.299 g/mol
Cas Number:
-
EINECS Number:
-
2,2-dimethyl-5-oxohexanal
Molecular Formula:
C
8
H
14
O
2
Molecular Weight:
142.198 g/mol
Cas Number:
-
EINECS Number:
-
4,4-dimethyl-2-cyclohexen-1-one
Molecular Formula:
C
8
H
12
O
Molecular Weight:
124.183 g/mol
Cas Number:
1073-13-8
EINECS Number:
-
DL-Mevalolactone
Molecular Formula:
C
6
H
10
O
3
Molecular Weight:
130.144 g/mol
Cas Number:
674-26-0
EINECS Number:
211-615-0
4-methyl-5,6-dihydro-2H-pyran-2-one
Molecular Formula:
C
6
H
8
O
2
Molecular Weight:
112.128 g/mol
Cas Number:
2381-87-5
EINECS Number:
-
N,N-diethyl-2-(methylanilino)benzamide
Molecular Formula:
C
18
H
22
N
2
O
Molecular Weight:
282.386 g/mol
Cas Number:
-
EINECS Number:
-
4-methoxy-10-methylacridin-9-one
Molecular Formula:
C
15
H
13
NO
2
Molecular Weight:
239.274 g/mol
Cas Number:
-
EINECS Number:
-
3-methoxy-1,3-dimethyl-4-phenyl-2-azetidinone
Molecular Formula:
C
12
H
15
NO
2
Molecular Weight:
205.257 g/mol
Cas Number:
82918-98-7
EINECS Number:
-
6-methoxy-6-methyl-4-thia-1-azabicyclo[3.2.0]heptan-7-one
Molecular Formula:
C
7
H
11
NO
2
S
Molecular Weight:
173.236 g/mol
Cas Number:
-
EINECS Number:
-
dimethyl 2-(4-formyl-2-cyclohexen-1-yl)malonate
Molecular Formula:
C
12
H
16
O
5
Molecular Weight:
240.256 g/mol
Cas Number:
-
EINECS Number:
-
dimethyl 2-(4-formyl-3-cyclohexen-1-yl)malonate
Molecular Formula:
C
12
H
16
O
5
Molecular Weight:
240.256 g/mol
Cas Number:
-
EINECS Number:
-
methyl 2-oxo-1-(1-phenyl-2-propenyl)cyclopentanecarboxylate
Molecular Formula:
C
16
H
18
O
3
Molecular Weight:
258.317 g/mol
Cas Number:
-
EINECS Number:
-
methyl 1-cinnamyl-2-oxocyclopentane-1-carboxylate
Molecular Formula:
C
16
H
18
O
3
Molecular Weight:
258.317 g/mol
Cas Number:
-
EINECS Number:
-
methyl 1-allyl-2-oxocyclopentanecarboxylate
Molecular Formula:
C
10
H
14
O
3
Molecular Weight:
182.219 g/mol
Cas Number:
-
EINECS Number:
-
2-butoxy-4-butyltetrahydrofuran
Molecular Formula:
C
12
H
24
O
2
Molecular Weight:
200.321 g/mol
Cas Number:
-
EINECS Number:
-
2-cyclohexylidene-ethylidene-cyclohexane
Molecular Formula:
C
14
H
22
Molecular Weight:
190.329 g/mol
Cas Number:
-
EINECS Number:
-
9,10-dimethylanthracene
Molecular Formula:
C
16
H
14
Molecular Weight:
206.287 g/mol
Cas Number:
781-43-1
EINECS Number:
212-308-4
allylcyclohexane
Molecular Formula:
C
9
H
16
Molecular Weight:
124.226 g/mol
Cas Number:
2114-42-3
EINECS Number:
218-316-4
2,2,3,3-tetramethyloxirane
Molecular Formula:
C
6
H
12
O
Molecular Weight:
100.161 g/mol
Cas Number:
5076-20-0
EINECS Number:
225-785-9
1-acetonylcyclohexane-1-carbonitrile
Molecular Formula:
C
10
H
15
NO
Molecular Weight:
165.235 g/mol
Cas Number:
-
EINECS Number:
-
2,2-dimethyl-4-oxopentanenitrile
Molecular Formula:
C
7
H
11
NO
Molecular Weight:
125.17 g/mol
Cas Number:
-
EINECS Number:
-
(2E)-5-(3,3-dimethyl-2-oxiranyl)-3-methyl-2-pentenyl acetate
Molecular Formula:
C
12
H
20
O
3
Molecular Weight:
212.289 g/mol
Cas Number:
37715-31-4
EINECS Number:
-
2-methyl-1,2,3,4-tetrahydro-pyridine-1-carboxylic acid methyl ester
Molecular Formula:
C
8
H
13
NO
2
Molecular Weight:
155.197 g/mol
Cas Number:
-
EINECS Number:
-
methyl 3-acetyl-5,6-dihydro-4H-pyridine-1-carboxylate
Molecular Formula:
C
9
H
13
NO
3
Molecular Weight:
183.207 g/mol
Cas Number:
-
EINECS Number:
-
(6Z)-6-(2-propenylidene)-5,6-dihydro-2H-pyran-2-one
Molecular Formula:
C
8
H
8
O
2
Molecular Weight:
136.15 g/mol
Cas Number:
-
EINECS Number:
-
6-[(1E)-1-propenyl]-2H-pyran-2-one
Molecular Formula:
C
8
H
8
O
2
Molecular Weight:
136.15 g/mol
Cas Number:
-
EINECS Number:
-
1-phenyl-2-nonanone
Molecular Formula:
C
15
H
22
O
Molecular Weight:
218.339 g/mol
Cas Number:
-
EINECS Number:
-
5-methyl-1-phenyl-2-hexanone
Molecular Formula:
C
13
H
18
O
Molecular Weight:
190.285 g/mol
Cas Number:
-
EINECS Number:
-
5-methyl-1-(4-methylphenyl)-2-hexanone
Molecular Formula:
C
14
H
20
O
Molecular Weight:
204.312 g/mol
Cas Number:
-
EINECS Number:
-
1-(4-methoxyphenyl)-5-methyl-2-hexanone
Molecular Formula:
C
14
H
20
O
2
Molecular Weight:
220.312 g/mol
Cas Number:
-
EINECS Number:
-
1-(4-acetylphenyl)-5-methyl-2-hexanone
Molecular Formula:
C
15
H
20
O
2
Molecular Weight:
232.323 g/mol
Cas Number:
-
EINECS Number:
-
3,3-dimethyl-1-phenyl-2-butanone
Molecular Formula:
C
12
H
16
O
Molecular Weight:
176.258 g/mol
Cas Number:
6721-67-1
EINECS Number:
-
4-methyl-1-phenyl-3-penten-2-one
Molecular Formula:
C
12
H
14
O
Molecular Weight:
174.243 g/mol
Cas Number:
-
EINECS Number:
-
1-(2-bromo-2-propenyl)cyclohexanol
Molecular Formula:
C
9
H
15
BrO
Molecular Weight:
219.122 g/mol
Cas Number:
-
EINECS Number:
-
3-methylene-1-oxaspiro[4.5]decan-2-one
Molecular Formula:
C
10
H
14
O
2
Molecular Weight:
166.22 g/mol
Cas Number:
52978-85-5
EINECS Number:
-
2-bromo-1-octen-4-ol
Molecular Formula:
C
8
H
15
BrO
Molecular Weight:
207.111 g/mol
Cas Number:
-
EINECS Number:
-
5-butyl-3-methylideneoxolan-2-one
Molecular Formula:
C
9
H
14
O
2
Molecular Weight:
154.209 g/mol
Cas Number:
-
EINECS Number:
-
1-tert-butyl-4-ethylidenecyclohexane
Molecular Formula:
C
12
H
22
Molecular Weight:
166.307 g/mol
Cas Number:
-
EINECS Number:
-
2-dimethylamino-ethanesulfonic acid 2-cyanoethyl ester
Molecular Formula:
C
7
H
14
N
2
O
3
S
Molecular Weight:
206.266 g/mol
Cas Number:
-
EINECS Number:
-
1
2
3
4
5
6
7
8
...
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