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2-Thiophenecarboxylic acid, 5-(4-hydroxy-1-pentenyl)-, methyl ester
SpectraBase Compound ID GLiB6V1Cho7
InChI InChI=1S/C11H14O3S/c1-8(12)4-3-5-9-6-7-10(15-9)11(13)14-2/h3,5-8,12H,4H2,1-2H3/b5-3-
InChIKey KTLWBWDYVKBSKC-HYXAFXHYSA-N
Mol Weight 226.29 g/mol
Molecular Formula C11H14O3S
Exact Mass 226.066365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DwAV32eDkqY
Name 2-Thiophenecarboxylic acid, 5-(4-hydroxy-1-pentenyl)-, methyl ester
Alternate Name(s) 5-(5-Methoxy carbonyl-2-thienyl)-4-pentene-2-ol Methyl 5-[(1Z)-4-hydroxy-1-pentenyl]-2-thiophenecarboxylate
CAS Registry Number 67137-63-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O3S
InChI InChI=1S/C11H14O3S/c1-8(12)4-3-5-9-6-7-10(15-9)11(13)14-2/h3,5-8,12H,4H2,1-2H3/b5-3-
InChIKey KTLWBWDYVKBSKC-HYXAFXHYSA-N
Molecular Weight 226.290 g/mol
SMILES OC(C\C=C/c1sc(C(=O)OC)cc1)C
SPLASH splash10-0002-9610000000-7c030ac7040e8390fe63
Source of Spectrum F-35-339-0
Wiley ID 1227005