| SpectraBase Spectrum ID |
2QwypNIBtCD |
| Name |
1-(1-Phenylthio-2-cyclohexenyl)-1-heptanone |
| Alternate Name(s) |
1-[1-(phenylsulfanyl)-2-cyclohexen-1-yl]-1-heptanone |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H26OS |
| InChI |
InChI=1S/C19H26OS/c1-2-3-4-9-14-18(20)19(15-10-6-11-16-19)21-17-12-7-5-8-13-17/h5,7-8,10,12-13,15H,2-4,6,9,11,14,16H2,1H3 |
| InChIKey |
LYUOOGXYOJEIIP-UHFFFAOYSA-N |
| Molecular Weight |
302.476 g/mol |
| SMILES |
C1(Sc2ccccc2)(C(=O)CCCCCC)C=CCCC1 |
| SPLASH |
splash10-000i-0900000000-9421768a3b634241edc9 |
| Source of Spectrum |
AJ-65-2971-5 |
| Wiley ID |
771783 |
