SpectraBase Compound ID | E9EK5qq22Fh |
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InChI | InChI=1S/C12H12O2S/c1-2-14-12(13)10-7-9-5-3-4-6-11(9)15-8-10/h3-7H,2,8H2,1H3 |
InChIKey | IWFLCMOFRJUGSA-UHFFFAOYSA-N |
Mol Weight | 220.29 g/mol |
Molecular Formula | C12H12O2S |
Exact Mass | 220.055801 g/mol |
SpectraBase Spectrum ID | A7cmscvCdcl |
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Name | Ethyl 2H-1-benzothiopyran-3-carboxylate |
Comments | Less than 3 mono-isotopic peaks |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C12H12O2S |
InChI | InChI=1S/C12H12O2S/c1-2-14-12(13)10-7-9-5-3-4-6-11(9)15-8-10/h3-7H,2,8H2,1H3 |
InChIKey | IWFLCMOFRJUGSA-UHFFFAOYSA-N |
Molecular Weight | 220.286 g/mol |
SMILES | C1(=Cc2ccccc2SC1)C(=O)OCC |
SPLASH | splash10-014i-0090000000-cddbff60ba995780a7ab |
Source of Spectrum | SO-0-2391-6 |
Wiley ID | 878982 |