| SpectraBase Spectrum ID |
5BGCu5FX20u |
| Name |
S-(4-allyl-2-methoxyphenyl) octanethioate |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H26O2S |
| InChI |
InChI=1S/C18H26O2S/c1-4-6-7-8-9-11-18(19)21-17-13-12-15(10-5-2)14-16(17)20-3/h5,12-14H,2,4,6-11H2,1,3H3 |
| InChIKey |
HVPOPWNIUIRAOP-UHFFFAOYSA-N |
| Instrument Name |
Bruker MS320 Triple quad |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/adsc.202101178 |
| Molecular Weight |
306.464 g/mol |
| Reported Formula |
C18H26O2S |
| SMILES |
C(Cc1cc(c(cc1)SC(CCCCCCC)=O)OC)=C |
| SPLASH |
splash10-001i-2900000000-45075f58ae2fb427363e |
| Source of Spectrum |
ASC-363-SM9-1l |
| Wiley ID |
1851371 |
