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Hexanophenone
SpectraBase Compound ID 62KePU9UDZS
InChI InChI=1S/C12H16O/c1-2-3-5-10-12(13)11-8-6-4-7-9-11/h4,6-9H,2-3,5,10H2,1H3
InChIKey MAHPVQDVMLWUAG-UHFFFAOYSA-N
Mol Weight 176.26 g/mol
Molecular Formula C12H16O
Exact Mass 176.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HQ7t4W7PmhV
Name 1-Phenylhexan-1-one
Appearance Colourless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 176.120115134 u
Formula C12H16O
GC Column HP-5
InChI InChI=1S/C12H16O/c1-2-3-5-10-12(13)11-8-6-4-7-9-11/h4,6-9H,2-3,5,10H2,1H3
InChIKey MAHPVQDVMLWUAG-UHFFFAOYSA-N
Instrument Name HP 6890N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201607072
Molecular Weight 176.259 g/mol
Quality 115
Reported Formula C12H16O
SMILES C1(=CC=CC=C1)C(CCCCC)=O
SPLASH splash10-0ab9-1900000000-05af29449734b833af98
Source of Spectrum ACI-55-SM8-7k (DOI: 10.1002/anie.201607072)
Wiley ID 1899303