| SpectraBase Spectrum ID |
KbWwHuJoeva |
| Name |
(1R*,2S*,5R*)-and-(1R*,2R*,5R*)-7-Cyclohexyl-5-methyl-2-(4-methylphenyl)-2-phenyl-6,7-thiazabicyclo[3.2.1]octane 6,6-dioxide |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H33NO2S |
| InChI |
InChI=1S/C26H33NO2S/c1-20-13-15-22(16-14-20)26(21-9-5-3-6-10-21)18-17-25(2)19-24(26)27(30(25,28)29)23-11-7-4-8-12-23/h3,5-6,9-10,13-16,23-24H,4,7-8,11-12,17-19H2,1-2H3/t24-,25+,26-/m1/s1 |
| InChIKey |
XALAWLXQLHJTHR-UODIDJSMSA-N |
| Molecular Weight |
423.615 g/mol |
| SMILES |
[C@]12(N(S([C@@](CC[C@]2(c2ccc(C)cc2)c2ccccc2)(C1)C)(=O)=O)C1CCCCC1)[H] |
| SPLASH |
splash10-0006-0900100000-a6007e708f6d39e1fef9 |
| Source of Spectrum |
F-54-8971-16 |
| Wiley ID |
808165 |
![(1R*,2S*,5R*)-and-(1R*,2R*,5R*)-7-Cyclohexyl-5-methyl-2-(4-methylphenyl)-2-phenyl-6,7-thiazabicyclo[3.2.1]octane 6,6-dioxide](/api/spectrum/KbWwHuJoeva/structure.png?h=300&w=458 "(1R*,2S*,5R*)-and-(1R*,2R*,5R*)-7-Cyclohexyl-5-methyl-2-(4-methylphenyl)-2-phenyl-6,7-thiazabicyclo[3.2.1]octane 6,6-dioxide")
