| SpectraBase Spectrum ID |
3VaPsIGPU7U |
| Name |
2,4,4-trimethyl-3-(phenylsulfanylmethyl)cyclohex-2-en-1-ol |
| Alternate Name(s) |
2,4,4-trimethyl-3-[(phenylthio)methyl]-1-cyclohex-2-enol |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H22OS |
| InChI |
InChI=1S/C16H22OS/c1-12-14(16(2,3)10-9-15(12)17)11-18-13-7-5-4-6-8-13/h4-8,15,17H,9-11H2,1-3H3 |
| InChIKey |
CIYDULBPFRYITI-UHFFFAOYSA-N |
| Molecular Weight |
262.411 g/mol |
| SMILES |
OC1C(=C(C(CC1)(C)C)CSc1ccccc1)C |
| SPLASH |
splash10-03di-0930000000-e132bdfa162b12fe6b7f |
| Source of Spectrum |
F-56-3931-13 |
| Wiley ID |
857124 |
