| SpectraBase Spectrum ID |
HERWQqzlfAS |
| Name |
Benzene, [(1-methyl-1-hexenyl)thio]- |
| Alternate Name(s) |
(1E)-1-methyl-1-hexenyl phenyl sulfide
2-Phenylthio-2-heptene
2-Phenylthiohept-2-ene
{[(1E)-1-methyl-1-hexenyl]sulfanyl}benzene |
| CAS Registry Number |
107014-77-7 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H18S |
| InChI |
InChI=1S/C13H18S/c1-3-4-6-9-12(2)14-13-10-7-5-8-11-13/h5,7-11H,3-4,6H2,1-2H3/b12-9+ |
| InChIKey |
KKGOAUHKSXBRTC-FMIVXFBMSA-N |
| Molecular Weight |
206.347 g/mol |
| SMILES |
C(\C=C/(Sc1ccccc1)C)CCC |
| SPLASH |
splash10-0a4i-0890000000-3d623dc2074b7da37f81 |
| Source of Spectrum |
KC-1986-191-0 |
| Wiley ID |
1204882 |
![Benzene, [(1-methyl-1-hexenyl)thio]-](/api/spectrum/HERWQqzlfAS/structure.png?h=300&w=458 "Benzene, [(1-methyl-1-hexenyl)thio]-")
