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Ethyl 2H-1-benzothiopyran-3-carboxylate
SpectraBase Compound ID E9EK5qq22Fh
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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A7cmscvCdcl
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