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2-(3-hydroxypent-1-ynyl)benzoic acid methyl ester
SpectraBase Compound ID DpFBp4ZbSO6
InChI InChI=1S/C13H14O3/c1-3-11(14)9-8-10-6-4-5-7-12(10)13(15)16-2/h4-7,11,14H,3H2,1-2H3
InChIKey VNNGHOOBZVGORT-UHFFFAOYSA-N
Mol Weight 218.25 g/mol
Molecular Formula C13H14O3
Exact Mass 218.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2YlgkyQvKkH
Name 2-(3-hydroxypent-1-ynyl)benzoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O3
InChI InChI=1S/C13H14O3/c1-3-11(14)9-8-10-6-4-5-7-12(10)13(15)16-2/h4-7,11,14H,3H2,1-2H3
InChIKey VNNGHOOBZVGORT-UHFFFAOYSA-N
Molecular Weight 218.252 g/mol
SMILES OC(C#Cc1c(C(=O)OC)cccc1)CC
SPLASH splash10-0pdi-1900000000-540920a39369aa690248
Source of Spectrum F-56-2540-10
Synonyms Methyl 2-(3-hydroxypent-1-ynyl)benzoate Methyl 2-(3-oxidanylpent-1-ynyl)benzoate
Wiley ID 856593