SpectraBase Compound ID | Ihyd2A7mwRs |
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InChI | InChI=1S/C11H14O2S/c1-3-13-11(12)8-14-10-7-5-4-6-9(10)2/h4-7H,3,8H2,1-2H3 |
InChIKey | WVJAFUBWGOQVDA-UHFFFAOYSA-N |
Mol Weight | 210.29 g/mol |
Molecular Formula | C11H14O2S |
Exact Mass | 210.071451 g/mol |
SpectraBase Spectrum ID | 4BDtt7F1X2n |
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Name | Ethyl 2-(o-tolylthio)acetate |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C11H14O2S |
InChI | InChI=1S/C11H14O2S/c1-3-13-11(12)8-14-10-7-5-4-6-9(10)2/h4-7H,3,8H2,1-2H3 |
InChIKey | WVJAFUBWGOQVDA-UHFFFAOYSA-N |
Instrument Name | Shimadzu GC-2010 |
Ionization Type | EI |
Molecular Weight | 210.291 g/mol |
SMILES | C(C)OC(CSc1c(cccc1)C)=O |
SPLASH | splash10-000i-0900000000-18f751f19f76390bda5f |
Source of Spectrum | WO2016086015A1 |
Wiley ID | 1853240 |