| SpectraBase Spectrum ID |
KO4rsOWBlub |
| Name |
2-(1-phenylsulfanyloctyl)cyclohex-2-en-1-one |
| Alternate Name(s) |
2-[1-(phenylthio)octyl]-1-cyclohex-2-enone
2-[1-(phenylthio)octyl]cyclohex-2-en-1-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H28OS |
| InChI |
InChI=1S/C20H28OS/c1-2-3-4-5-9-16-20(18-14-10-11-15-19(18)21)22-17-12-7-6-8-13-17/h6-8,12-14,20H,2-5,9-11,15-16H2,1H3 |
| InChIKey |
NSWHGFIVEJPGPY-UHFFFAOYSA-N |
| Molecular Weight |
316.503 g/mol |
| SMILES |
C1(C(=CCCC1)C(CCCCCCC)Sc1ccccc1)=O |
| SPLASH |
splash10-0a4i-0090000000-9f7ca8dc060315b9a9d4 |
| Source of Spectrum |
KC-0-1552-8 |
| Wiley ID |
781276 |
