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1-Phenyl-4-octanone

View entire compound with spectra: 1 MS (GC)

1-Phenyl-4-octanone
SpectraBase Compound ID CXHqZNxtyl
InChI InChI=1S/C14H20O/c1-2-3-11-14(15)12-7-10-13-8-5-4-6-9-13/h4-6,8-9H,2-3,7,10-12H2,1H3
InChIKey YIYCWJWUZUBPLY-UHFFFAOYSA-N
Mol Weight 204.31 g/mol
Molecular Formula C14H20O
Exact Mass 204.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HiyIIE8U5Ii
Name 1-Phenyl-4-octanone
CAS Registry Number 78427-96-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O
InChI InChI=1S/C14H20O/c1-2-3-11-14(15)12-7-10-13-8-5-4-6-9-13/h4-6,8-9H,2-3,7,10-12H2,1H3
InChIKey YIYCWJWUZUBPLY-UHFFFAOYSA-N
Molecular Weight 204.313 g/mol
SMILES C(=O)(CCCc1ccccc1)CCCC
SPLASH splash10-0udl-8940000000-470d82ab6f54e8023c43
Source of Spectrum J-48-5254-0
Synonyms 1-Phenyloctan-4-one
Wiley ID 1202249