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3,4,4-trimethyl-1-phenyl-1-pentanone
SpectraBase Compound ID LYiYOOKYlqm
InChI InChI=1S/C14H20O/c1-11(14(2,3)4)10-13(15)12-8-6-5-7-9-12/h5-9,11H,10H2,1-4H3
InChIKey MEGIABMYUQSDIU-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 Gy9Ao26hHFq
Name 3,4,4-trimethyl-1-phenyl-1-pentanone
Alternate Name(s) 3,4,4-trimethyl-1-phenylpentan-1-one
CAS Registry Number 56068-57-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O
InChI InChI=1S/C14H20O/c1-11(14(2,3)4)10-13(15)12-8-6-5-7-9-12/h5-9,11H,10H2,1-4H3
InChIKey MEGIABMYUQSDIU-UHFFFAOYSA-N
Molecular Weight 204.313 g/mol
SMILES C(CC(C(C)(C)C)C)(=O)c1ccccc1
SPLASH splash10-0a4j-4900000000-3c92b8470e01f8144b20
Source of Spectrum C-97-2790-0
Wiley ID 1202254