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Octanophenone

View entire compound with spectra: 4 NMR, 6 FTIR, and 5 MS (GC)

Octanophenone
SpectraBase Compound ID EXmJfjPF41y
InChI InChI=1S/C14H20O/c1-2-3-4-5-9-12-14(15)13-10-7-6-8-11-13/h6-8,10-11H,2-5,9,12H2,1H3
InChIKey UDEVCZRUNOLVLU-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 HoJ2vXELy2t
Name 1-Phenyl-1-octanone
Alternate Name(s) 1-Octanone, 1-phenyl- 1-Phenyloctan-1-one Caprylophenone Heptyl phenyl ketone Ketone, heptyl phenyl n-Octanophenone Octanophenone EINECS 216-817-2 NSC 22009
CAS Registry Number 1674-37-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O
InChI InChI=1S/C14H20O/c1-2-3-4-5-9-12-14(15)13-10-7-6-8-11-13/h6-8,10-11H,2-5,9,12H2,1H3
InChIKey UDEVCZRUNOLVLU-UHFFFAOYSA-N
Molecular Weight 204.313 g/mol
SMILES c1cc(ccc1)C(=O)CCCCCCC
SPLASH splash10-0ab9-1900000000-9b4610ab4a1ed62e8719
Source of Spectrum J-67-82-4
Wiley ID 1568846