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3-Thiopheneacetic acid, .alpha.-5-hexynyl-
SpectraBase Compound ID FeOorYNW3Uj
InChI InChI=1S/C12H14O2S/c1-2-3-4-5-6-11(12(13)14)10-7-8-15-9-10/h1,7-9,11H,3-6H2,(H,13,14)
InChIKey NUOBKLYQRFIUNH-UHFFFAOYSA-N
Mol Weight 222.3 g/mol
Molecular Formula C12H14O2S
Exact Mass 222.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EM1YdtX5ET
Name 3-Thiopheneacetic acid, .alpha.-5-hexynyl-
CAS Registry Number 132526-24-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O2S
InChI InChI=1S/C12H14O2S/c1-2-3-4-5-6-11(12(13)14)10-7-8-15-9-10/h1,7-9,11H,3-6H2,(H,13,14)
InChIKey NUOBKLYQRFIUNH-UHFFFAOYSA-N
Molecular Weight 222.302 g/mol
SMILES OC(C(c1cscc1)CCCCC#C)=O
SPLASH splash10-0002-9710000000-854eec95e2948a3fd7e7
Source of Spectrum KC-1990-2917-20
Synonyms 2-(3-Thienyl)-7-octynoic acid 2-(3-Thienyl)oct-7-ynoic acid
Wiley ID 1222152