| SpectraBase Spectrum ID |
48j8IAfAiEI |
| Name |
methyl 4-(1-(4-(methylthio)phenyl)ethyl)benzoate |
| Appearance |
Waxy oil |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
286.102750992 u |
| Formula |
C17H18O2S |
| InChI |
InChI=1S/C17H18O2S/c1-12(14-8-10-16(20-3)11-9-14)13-4-6-15(7-5-13)17(18)19-2/h4-12H,1-3H3 |
| InChIKey |
FLXMWUSLVKWDMY-UHFFFAOYSA-N |
| Instrument Name |
FINNIGAN MAT 95Q |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202101682 |
| Quality |
26 |
| Reported Formula |
C17H18O2S |
| SMILES |
C=1(C(C)C=2C=CC(=CC2)SC)C=CC(=CC1)C(=O)OC |
| SPLASH |
splash10-00di-0290000000-89c4f0f67d7d18451abc |
| Source of Spectrum |
ACI-60-SM32-6d (DOI: 10.1002/anie.202101682) |
| Wiley ID |
1891274 |
