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4-Hydroxy-1-phenylbut-2-yn-1-one
SpectraBase Compound ID 9KIu5qCphNm
InChI InChI=1S/C10H8O2/c11-8-4-7-10(12)9-5-2-1-3-6-9/h1-3,5-6,11H,8H2
InChIKey NWLZAQXAJNDAIK-UHFFFAOYSA-N
Mol Weight 160.17 g/mol
Molecular Formula C10H8O2
Exact Mass 160.052429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 38YENcmW48
Name 4-Hydroxy-1-phenylbut-2-yn-1-one
Appearance Brown oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 160.052429496 u
Formula C10H8O2
GC Column Macherey-Nagel OPTIMA1 or Macherey-Nagel OPTIMA5 (25 m x 0.2 mm or 30 m x 0.25 mm, film thickness 0.35 micrometer or 0.25 micrometer)
InChI InChI=1S/C10H8O2/c11-8-4-7-10(12)9-5-2-1-3-6-9/h1-3,5-6,11H,8H2
InChIKey NWLZAQXAJNDAIK-UHFFFAOYSA-N
Instrument Name 5903 series II or HP6890-HP5970A
Ionization Type EI
Literature Reference DOI 10.1002/chem.201404903
Molecular Weight 160.172 g/mol
Quality 312
SMILES OCC#CC(=O)C1=CC=CC=C1
SPLASH splash10-0ufr-9600000000-350005e4c38f21b98597
Source of Spectrum QE-21-SM15-35 (DOI: 10.1002/chem.201404903)
Thin-Layer Chromatography 0.39 (SiO2, cyclohexane/EtOAc, 1:1)
Wiley ID 1906984