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2-thiophenecarboxylic acid, phenacyl ester
SpectraBase Compound ID 7AiOS5KeGOC
InChI InChI=1S/C13H10O3S/c14-11(10-5-2-1-3-6-10)9-16-13(15)12-7-4-8-17-12/h1-8H,9H2
InChIKey SGPCEFGITALHGC-UHFFFAOYSA-N
Mol Weight 246.28 g/mol
Molecular Formula C13H10O3S
Exact Mass 246.035065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3cGl0ym0vo
Name 2-Oxo-2-phenylethyl 2-thiophenecarboxylate
Alternate Name(s) 2-Thiophenecarboxylic acid phenacyl ester phenacyl thiophene-2-carboxylate thiophene-2-carboxylic acid phenacyl ester Thiophene-2-carboxylic acid, (2-oxo-2-phenylethyl) ester
CAS Registry Number 284665-52-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10O3S
InChI InChI=1S/C13H10O3S/c14-11(10-5-2-1-3-6-10)9-16-13(15)12-7-4-8-17-12/h1-8H,9H2
InChIKey SGPCEFGITALHGC-UHFFFAOYSA-N
Molecular Weight 246.280 g/mol
SMILES c1(C(OCC(=O)c2ccccc2)=O)sccc1
SPLASH splash10-0a4i-4900000000-959f37069f377efdcf41
Source of Spectrum AD-0-2532-0
Wiley ID 1433188