| SpectraBase Spectrum ID |
EBeB0pwI7s3 |
| Name |
2,5,5-Trimethyl-6-(phenylthio)-3,6-heptadien-2-ol |
| Alternate Name(s) |
(3E)-2,5,5-trimethyl-6-(phenylsulfanyl)-3,6-heptadien-2-ol |
| CAS Registry Number |
78715-46-5 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H22OS |
| InChI |
InChI=1S/C16H22OS/c1-13(18-14-9-7-6-8-10-14)15(2,3)11-12-16(4,5)17/h6-12,17H,1H2,2-5H3/b12-11+ |
| InChIKey |
WAXMJJLJLWEPOJ-VAWYXSNFSA-N |
| Molecular Weight |
262.411 g/mol |
| SMILES |
OC(\C=C\C(C(Sc1ccccc1)=C)(C)C)(C)C |
| SPLASH |
splash10-0006-9020000000-63256fab6d39e900b0c1 |
| Source of Spectrum |
J-46-4338-0 |
| Wiley ID |
1266081 |
