| SpectraBase Spectrum ID |
Jt8eEnehnk8 |
| Name |
Cyclohexanol, 2,2-dimethyl-4-methylene-5-(phenylsulfonyl)-, (1S-trans)- |
| Alternate Name(s) |
(1S,3S)-6,6-Dimethyl-4-methylene-3-(phenylsulfonyl)cyclohexan-1-ol
(1S,5S)-2,2-dimethyl-4-methylene-5-(phenylsulfonyl)cyclohexanol |
| CAS Registry Number |
116279-75-5 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H20O3S |
| InChI |
InChI=1S/C15H20O3S/c1-11-10-15(2,3)14(16)9-13(11)19(17,18)12-7-5-4-6-8-12/h4-8,13-14,16H,1,9-10H2,2-3H3/t13-,14-/m0/s1 |
| InChIKey |
JCSPEPVJABYOKR-KBPBESRZSA-N |
| Molecular Weight |
280.382 g/mol |
| SMILES |
O[C@@]1(C(C)(C)CC([C@@](S(=O)(=O)c2ccccc2)(C1)[H])=C)[H] |
| SPLASH |
splash10-000i-0900000000-d8e65be44c53e2be6cda |
| Source of Spectrum |
J-53-4872-5 |
| Wiley ID |
1283770 |
