| SpectraBase Spectrum ID |
1OmMnu7TSSN |
| Name |
(3R,4S)-2-cyclohexyl-3-(4-methylphenyl)-4-phenyl-1,2-thiazetidine 1,1-dioxide |
| Alternate Name(s) |
(3R,4S)-2-cyclohexyl-3-(4-methylphenyl)-4-phenylthiazetidine 1,1-dioxide
(3R,4S)-2-cyclohexyl-4-phenyl-3-(p-tolyl)thiazetidine 1,1-dioxide |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H25NO2S |
| InChI |
InChI=1S/C21H25NO2S/c1-16-12-14-17(15-13-16)20-21(18-8-4-2-5-9-18)25(23,24)22(20)19-10-6-3-7-11-19/h2,4-5,8-9,12-15,19-21H,3,6-7,10-11H2,1H3/t20-,21+/m1/s1 |
| InChIKey |
SSSQVFMMODTUKU-RTWAWAEBSA-N |
| Molecular Weight |
355.496 g/mol |
| SMILES |
C1(N2S([C@]([C@]2(c2ccc(cc2)C)[H])(c2ccccc2)[H])(=O)=O)CCCCC1 |
| SPLASH |
splash10-0a4i-0091000000-0366315824b352a471d3 |
| Source of Spectrum |
F-54-8952-1 |
| Wiley ID |
807960 |
