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Valerophenone
SpectraBase Compound ID LDSpX16KzTn
InChI InChI=1S/C11H14O/c1-2-3-9-11(12)10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3
InChIKey XKGLSKVNOSHTAD-UHFFFAOYSA-N
Mol Weight 162.23 g/mol
Molecular Formula C11H14O
Exact Mass 162.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JF6oU0kV9Um
Name 1-Phenylpentan-1-one
CAS Registry Number 1009-14-9
Classification Designer drug precursor
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 162.104465070 u
Formula C11H14O
InChI InChI=1S/C11H14O/c1-2-3-9-11(12)10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3
InChIKey XKGLSKVNOSHTAD-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 162.232 g/mol
Nominal Mass 162 u
Quality 961
Retention Index 1182
SMILES C=1(C(CCCC)=O)C=CC=CC1
SPLASH splash10-0ab9-4900000000-113837026b3a9b2f8187
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Pentiophenone
Technique GC/MS
Wiley ID DD2024_003602