Journal of the American Chemical Society - 6333 compounds - page 41
| 3,4-dihydroxy-3-cyclobutene-1,2-dione | ||
|---|---|---|
Molecular Formula: |
C4H2O4 |
|
Molecular Weight: |
114.057 g/mol |
|
Cas Number: |
2892-51-5 |
|
InChIKey: |
PWEBUXCTKOWPCW-UHFFFAOYAC |
|
| 7-phenyl-7-azabicyclo[4.2.0]octa-1,3,5-triene | ||
Molecular Formula: |
C13H11N |
|
Molecular Weight: |
181.237 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
KZIHOVHVOLUGHV-UHFFFAOYAB |
|
| diethyl 1-methyl-2-oxo-1-phenylethylphosphonate | ||
Molecular Formula: |
C13H19O4P |
|
Molecular Weight: |
270.265 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
PMXUYLIJKBSIQA-UHFFFAOYAE |
|
| 2-(1-methyl-2-phenylethoxy)ethanethiol | ||
Molecular Formula: |
C11H16OS |
|
Molecular Weight: |
196.313 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
ZRJRDEWNYHKCGI-UHFFFAOYAW |
|
| 2-(isobutylsulfanyl)ethanethiol | ||
Molecular Formula: |
C6H14S2 |
|
Molecular Weight: |
150.309 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
PLFYWXBVQAASLC-UHFFFAOYAE |
|
| 1-phenylethyl acetate | ||
Molecular Formula: |
C10H12O2 |
|
Molecular Weight: |
164.204 g/mol |
|
Cas Number: |
93-92-5 |
|
InChIKey: |
QUMXDOLUJCHOAY-UHFFFAOYAA |
|
| 1-tetralin-2-ylazepane | ||
Molecular Formula: |
C16H23N |
|
Molecular Weight: |
229.365 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
NGYPTABXXSQOAZ-UHFFFAOYAM |
|
| 2,5-diphenyl-1,3-oxazole | ||
Molecular Formula: |
C15H11NO |
|
Molecular Weight: |
221.258 g/mol |
|
Cas Number: |
92-71-7 |
|
InChIKey: |
CNRNYORZJGVOSY-UHFFFAOYAG |
|
| 1-adamantyl chloridocarbonate | ||
Molecular Formula: |
C11H15ClO2 |
|
Molecular Weight: |
214.692 g/mol |
|
Cas Number: |
5854-52-4 |
|
InChIKey: |
MYTHPILJALAOHO-UHFFFAOYAK |
|
| isopropenyl acetate | ||
Molecular Formula: |
C5H8O2 |
|
Molecular Weight: |
100.117 g/mol |
|
Cas Number: |
108-22-5 |
|
InChIKey: |
HETCEOQFVDFGSY-UHFFFAOYAT |
|
| (2E)-2-butenyl acetate | ||
Molecular Formula: |
C6H10O2 |
|
Molecular Weight: |
114.144 g/mol |
|
Cas Number: |
628-08-0 |
|
InChIKey: |
WNHXJHGRIHUOTG-ONEGZZNKBM |
|
| N,N-diethyl-2H-azepin-7-amine | ||
Molecular Formula: |
C10H16N2 |
|
Molecular Weight: |
164.251 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
LZLBYOUTOIVECJ-UHFFFAOYAS |
|
| N,N-diethyl-3H-azepin-2-amine | ||
Molecular Formula: |
C10H16N2 |
|
Molecular Weight: |
164.251 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
MGTZXMILRQSSPS-UHFFFAOYAF |
|
| N,N,N,N,N,N,N,N-octamethylmethanetetramine | ||
Molecular Formula: |
C9H24N4 |
|
Molecular Weight: |
188.317 g/mol |
|
Cas Number: |
10524-51-3 |
|
InChIKey: |
GBNYRNDJAGSSFQ-UHFFFAOYAA |
|
| N-bromo-N-tert-butylpentanamide | ||
Molecular Formula: |
C9H18BrNO |
|
Molecular Weight: |
236.152 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
JXAHBQUVXJBNNM-UHFFFAOYAF |
|
| N-tert-butyl-5-methyloxolan-2-imine | ||
Molecular Formula: |
C9H17NO |
|
Molecular Weight: |
155.24 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
QXWNSSBNEAMXNN-NTMALXAHBU |
|
| N-(2-pyrrolidinylcarbonyl)phenylalanine | ||
Molecular Formula: |
C14H18N2O3 |
|
Molecular Weight: |
262.309 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
IWIANZLCJVYEFX-CUNFQGHECT |
|
| 8-oxooctanenitrile | ||
Molecular Formula: |
C8H13NO |
|
Molecular Weight: |
139.197 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
GPIYCUTWSGJWLF-UHFFFAOYAE |
|
| (2Z)-3-tert-butoxy-2-butenenitrile | ||
Molecular Formula: |
C8H13NO |
|
Molecular Weight: |
139.197 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
YWJBLSNKEXYQTI-ALCCZGGFBJ |
|
| 4-tert-butylimino-but-3-en-2-one | ||
Molecular Formula: |
C8H13NO |
|
Molecular Weight: |
139.197 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
AEJLSLGWCJYFSJ-UHFFFAOYAZ |
|
| N-methyl-3-phenyl-2H-isoindole-1-carboxamide | ||
Molecular Formula: |
C16H14N2O |
|
Molecular Weight: |
250.3 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
PUKABOSBRSFMTN-HCKMINDGCD |
|
| methyl 2-oxo-1,2,3,4-tetrahydro-1-naphthalenecarboxylate | ||
Molecular Formula: |
C12H12O3 |
|
Molecular Weight: |
204.225 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
GLARUGUGPKWING-UHFFFAOYAZ |
|
| 2-tert-butoxy-1,3,2-benzodioxaphosphole 2-oxide | ||
Molecular Formula: |
C10H13O4P |
|
Molecular Weight: |
228.185 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
ZWICWMVKOBAJFH-UHFFFAOYAF |
|
| tert-butyl 2-hydroxyphenyl hydrogen phosphate | ||
Molecular Formula: |
C10H15O5P |
|
Molecular Weight: |
246.2 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
TXXVNJZAOJICJX-XWKXFZRBCZ |
|
| 2-isopropyl-1-benzothiophene | ||
Molecular Formula: |
C11H12S |
|
Molecular Weight: |
176.282 g/mol |
|
Cas Number: |
39743-75-4 |
|
InChIKey: |
LPCZLJKNCRRQFN-UHFFFAOYAB |
|
| 5-amino-2-methyl-1,3-oxazole-4-carbonitrile | ||
Molecular Formula: |
C5H5N3O |
|
Molecular Weight: |
123.114 g/mol |
|
Cas Number: |
5098-16-8 |
|
InChIKey: |
OVIXKBXQNCJGDG-UHFFFAOYAO |
|
| 9H-purin-6-amine | ||
Molecular Formula: |
C5H5N5 |
|
Molecular Weight: |
135.128 g/mol |
|
Cas Number: |
73-24-5 |
|
InChIKey: |
GFFGJBXGBJISGV-KYDDBTJZCX |
|
| 1,1-dimethyl-2-thioxohydrazine | ||
Molecular Formula: |
C2H6N2S |
|
Molecular Weight: |
90.149 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
XEZXRTQBVHVPOS-UHFFFAOYAJ |
|
| 1-indolinamine | ||
Molecular Formula: |
C8H10N2 |
|
Molecular Weight: |
134.181 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
WLFGGJFWKXTOGJ-UHFFFAOYAW |
|
| (6-oxo-1,2,4,5,6,7-hexahydroazepino[3,2,1-hi]indol-7-yl)acetonitrile | ||
Molecular Formula: |
C14H14N2O |
|
Molecular Weight: |
226.278 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
OVCVKGMJIPWFGA-UHFFFAOYAW |
|
| 1-indolin-7-ylacetone | ||
Molecular Formula: |
C11H13NO |
|
Molecular Weight: |
175.23 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
SKYWAYZMVTXVQW-UHFFFAOYAU |
|
| amino(4-hydroxy-3-nitrophenyl)acetic acid | ||
Molecular Formula: |
C8H8N2O5 |
|
Molecular Weight: |
212.162 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
WPJSXUYBLQGKHR-XWKXFZRBCM |
|
| 5-(4-methoxyphenoxy)-1-phenyl-1H-tetraazole | ||
Molecular Formula: |
C14H12N4O2 |
|
Molecular Weight: |
268.275 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
SUTBEHZLUBNRES-UHFFFAOYAZ |
|
| 2,3-diisopropylidene-1,1-dimethyl-cyclopropane | ||
Molecular Formula: |
C11H18 |
|
Molecular Weight: |
150.264 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
OUVVCPGFEIBUCG-UHFFFAOYAE |
|
| 4-methoxyphenyl benzoate | ||
Molecular Formula: |
C14H12O3 |
|
Molecular Weight: |
228.247 g/mol |
|
Cas Number: |
1523-19-9 |
|
InChIKey: |
PMRMHHUTWZPFIY-UHFFFAOYAV |
|
| 1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl hypofluorite | ||
Molecular Formula: |
C3F8O |
|
Molecular Weight: |
204.02 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
UJMFNQDEYNKJPF-UHFFFAOYAJ |
|
| 3-(4-nitrophenyl)-3H-diazirene | ||
Molecular Formula: |
C7H5N3O2 |
|
Molecular Weight: |
163.136 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
CXFLIPFWNGCYFD-UHFFFAOYAJ |
|
| 6,6-diphenylbicyclo[3.1.0]hex-3-en-2-one | ||
Molecular Formula: |
C18H14O |
|
Molecular Weight: |
246.309 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
GMFRYGQSVPUWOJ-UHFFFAOYAM |
|
| 6H-benzo[c]chromen-6-one | ||
Molecular Formula: |
C13H8O2 |
|
Molecular Weight: |
196.205 g/mol |
|
Cas Number: |
2005-10-9 |
|
InChIKey: |
TVKNXKLYVUVOCV-UHFFFAOYAL |
|
| 2,3-dihydroxy-1,4-diphenyl-1,4-butanedione | ||
Molecular Formula: |
C16H14O4 |
|
Molecular Weight: |
270.285 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
VIFZKKRMGBCZON-UHFFFAOYAK |
|
| S-methyl 2-oxo-2-phenylethanethioate | ||
Molecular Formula: |
C9H8O2S |
|
Molecular Weight: |
180.227 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
SXGOMANQSMGEEE-UHFFFAOYAP |
|
| Methyl phenacyl sulfoxide | ||
Molecular Formula: |
C9H10O2S |
|
Molecular Weight: |
182.243 g/mol |
|
Cas Number: |
2813-22-1 |
|
InChIKey: |
MJYVAVACHZIDHQ-UHFFFAOYAY |
|
| 2-hydroxy-2-methylsulfanyl-1-phenylethanone | ||
Molecular Formula: |
C9H10O2S |
|
Molecular Weight: |
182.243 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
DDOCBHMYKPPUPV-UHFFFAOYAD |
|
| 1-phenyl-1,2-ethanediol | ||
Molecular Formula: |
C8H10O2 |
|
Molecular Weight: |
138.166 g/mol |
|
Cas Number: |
93-56-1 |
|
InChIKey: |
PWMWNFMRSKOCEY-UHFFFAOYAB |
|
| 2,3-diphenyl-2,3-butanediol | ||
Molecular Formula: |
C16H18O2 |
|
Molecular Weight: |
242.318 g/mol |
|
Cas Number: |
1636-34-6 |
|
InChIKey: |
URPRLFISKOCZHR-UHFFFAOYAT |
|
| 3,3-dimethyl-2-butanone | ||
Molecular Formula: |
C6H12O |
|
Molecular Weight: |
100.161 g/mol |
|
Cas Number: |
75-97-8 |
|
InChIKey: |
PJGSXYOJTGTZAV-UHFFFAOYAH |
|
| 2-bromo-2-methylthiirane 1,1-dioxide | ||
Molecular Formula: |
C3H5BrO2S |
|
Molecular Weight: |
185.042 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
WWPUFFUIOTWPPO-UHFFFAOYAN |
|
| 6-chloro-6-methoxyhexanenitrile | ||
Molecular Formula: |
C7H12ClNO |
|
Molecular Weight: |
161.631 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
VJLLYUZMLREEPV-UHFFFAOYAS |
|
| 6,6-diethoxyhexanenitrile | ||
Molecular Formula: |
C10H19NO2 |
|
Molecular Weight: |
185.266 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
LBFUFZGESLWTFP-UHFFFAOYAO |
|
| 2-chloro-3-ethoxy-1,3-cycloheptadiene | ||
Molecular Formula: |
C9H13ClO |
|
Molecular Weight: |
172.654 g/mol |
|
Cas Number: |
n/a |
|
InChIKey: |
SBJSQLMZNAHWBD-UHFFFAOYAR |
|