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4-(Prop-2-yn-1-yloxy)benzoic Acid

View entire compound with spectra: 1 MS (GC)

4-(Prop-2-yn-1-yloxy)benzoic Acid
SpectraBase Compound ID 5QMs2QFmpJb
InChI InChI=1S/C10H8O3/c1-2-7-13-9-5-3-8(4-6-9)10(11)12/h1,3-6H,7H2,(H,11,12)
InChIKey HRFYYZJGIFWLQF-UHFFFAOYSA-N
Mol Weight 176.17 g/mol
Molecular Formula C10H8O3
Exact Mass 176.047344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CVvigZrw5WR
Name 4-(Prop-2-yn-1-yloxy)benzoic Acid
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 176.047344115 u
Formula C10H8O3
InChI InChI=1S/C10H8O3/c1-2-7-13-9-5-3-8(4-6-9)10(11)12/h1,3-6H,7H2,(H,11,12)
InChIKey HRFYYZJGIFWLQF-UHFFFAOYSA-N
Instrument Name Waters Micromass GC-TOF
Ionization Type EI
Literature Reference DOI 10.1002/chem.201800389
Molecular Weight 176.171 g/mol
Quality 137
SMILES OC(C1=CC=C(C=C1)OCC#C)=O
SPLASH splash10-0udi-2900000000-81bdcf31f9a1a79b9a17
Source of Spectrum QE-24-SM6-7 (DOI: 10.1002/chem.201800389)
Wiley ID 1901568