| SpectraBase Spectrum ID |
5ESP2E7FJ2p |
| Name |
2-methyl-1-(phenylthio)-1,3-butadiene |
| Alternate Name(s) |
(1E)-2-methyl-1,3-butadienyl phenyl sulfide
{[(1E)-2-methyl-1,3-butadienyl]sulfanyl}benzene |
| CAS Registry Number |
16061-69-1 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H12S |
| InChI |
InChI=1S/C11H12S/c1-3-10(2)9-12-11-7-5-4-6-8-11/h3-9H,1H2,2H3/b10-9+ |
| InChIKey |
PDHCMLAMASJMPH-MDZDMXLPSA-N |
| Molecular Weight |
176.277 g/mol |
| SMILES |
C(\C(=C\Sc1ccccc1)C)=C |
| SPLASH |
splash10-0a4i-0900000000-af66d50da9549d2158e9 |
| Source of Spectrum |
J-51-3990-14 |
| Wiley ID |
1172541 |
