| SpectraBase Spectrum ID |
8WHAXTCDLm3 |
| Name |
5-(benzenesulfonyl)-3-cyano-2-hydroxy-4,6-diphenylbenzoic acid ethyl ester |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H21NO5S |
| InChI |
InChI=1S/C28H21NO5S/c1-2-34-28(31)25-24(20-14-8-4-9-15-20)27(35(32,33)21-16-10-5-11-17-21)23(22(18-29)26(25)30)19-12-6-3-7-13-19/h3-17,30H,2H2,1H3 |
| InChIKey |
XYIMZVBTNHDKTC-UHFFFAOYSA-N |
| Molecular Weight |
483.538 g/mol |
| SMILES |
Oc1c(c(c(S(=O)(=O)c2ccccc2)c(c1C(=O)OCC)-c1ccccc1)-c1ccccc1)C#N |
| SPLASH |
splash10-0002-0090100000-b53871a3416ee78311aa |
| Source of Spectrum |
KC-0-3689-16 |
| Synonyms |
5-besyl-3-cyano-2-hydroxy-4,6-diphenyl-benzoic acid ethyl ester
ethyl 3-cyano-2-oxidanyl-4,6-diphenyl-5-(phenylsulfonyl)benzoate
ethyl 5-(benzenesulfonyl)-3-cyano-2-hydroxy-4,6-diphenyl-benzoate |
| Wiley ID |
831898 |
