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4-(p-Hydroxyphenyl)-2-butanone
SpectraBase Compound ID JuWXr9IhDyw
InChI InChI=1S/C10H12O2/c1-8(11)2-3-9-4-6-10(12)7-5-9/h4-7,12H,2-3H2,1H3
InChIKey NJGBTKGETPDVIK-UHFFFAOYSA-N
Mol Weight 164.2 g/mol
Molecular Formula C10H12O2
Exact Mass 164.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8FoNLzQipFo
Name 4-(4-Hydroxyphenyl)butan-2-one
CAS Registry Number 5471-51-2
Classification Chemical
Comments Spectrum verified by crosschecking against external libraries (two reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 164.083729624 u
Formula C10H12O2
InChI InChI=1S/C10H12O2/c1-8(11)2-3-9-4-6-10(12)7-5-9/h4-7,12H,2-3H2,1H3
InChIKey NJGBTKGETPDVIK-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 164.204 g/mol
Nominal Mass 164 u
Quality 988
Retention Index 1191
SMILES OC=1C=CC(=CC1)CCC(=O)C
SPLASH splash10-0a4l-6900000000-f295f9f89f9e88766da0
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-(4-hydroxyphenyl)butan-2-one
Technique GC/MS
Wiley ID DD2024_007408