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4'-Fluorovalerophenone
SpectraBase Compound ID I35hkGKvK7l
InChI InChI=1S/C11H13FO/c1-2-3-4-11(13)9-5-7-10(12)8-6-9/h5-8H,2-4H2,1H3
InChIKey HBJRRAMFTUDWMQ-UHFFFAOYSA-N
Mol Weight 180.22 g/mol
Molecular Formula C11H13FO
Exact Mass 180.095043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2lpZhjRBpDM
Name 4'-Fluorovalerophenone
CAS Registry Number 29114-66-7
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 180.095043201 u
Formula C11H13FO
InChI InChI=1S/C11H13FO/c1-2-3-4-11(13)9-5-7-10(12)8-6-9/h5-8H,2-4H2,1H3
InChIKey HBJRRAMFTUDWMQ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 180.222 g/mol
Nominal Mass 180 u
Quality 911
Retention Index 1300
SMILES C=1(C(CCCC)=O)C=CC(=CC1)F
SPLASH splash10-00di-7900000000-dab5a7e2a3089e199128
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-(4-Fluorophenyl)-1-pentanone
Technique GC/MS
Wiley ID DD2024_021631