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3-Thiopheneacetic acid, .alpha.-4-pentynyl-
SpectraBase Compound ID 1GR78kHecxh
InChI InChI=1S/C11H12O2S/c1-2-3-4-5-10(11(12)13)9-6-7-14-8-9/h1,6-8,10H,3-5H2,(H,12,13)
InChIKey KIVWJHDKBHMFGB-UHFFFAOYSA-N
Mol Weight 208.27 g/mol
Molecular Formula C11H12O2S
Exact Mass 208.055801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2PYMN6KuHQu
Name 3-Thiopheneacetic acid, .alpha.-4-pentynyl-
CAS Registry Number 132526-23-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O2S
InChI InChI=1S/C11H12O2S/c1-2-3-4-5-10(11(12)13)9-6-7-14-8-9/h1,6-8,10H,3-5H2,(H,12,13)
InChIKey KIVWJHDKBHMFGB-UHFFFAOYSA-N
Molecular Weight 208.275 g/mol
SMILES OC(C(c1cscc1)CCCC#C)=O
SPLASH splash10-03dj-8910000000-45637cb1154966202e7b
Source of Spectrum KC-1990-2916-20
Synonyms 2-(3-Thienyl)-6-heptynoic acid 2-(3-Thienyl)hept-6-ynic acid
Wiley ID 1206494