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4-METHYL-4-PROPYL-2,5-CYCLOHEXADIEN-1-ON

View entire compound with spectra: 6 NMR, and 1 MS (GC)

4-METHYL-4-PROPYL-2,5-CYCLOHEXADIEN-1-ON
SpectraBase Compound ID JtiXUdU5kI5
InChI InChI=1S/C10H14O/c1-3-6-10(2)7-4-9(11)5-8-10/h4-5,7-8H,3,6H2,1-2H3
InChIKey PLOHYFCKPPQFOC-UHFFFAOYSA-N
Mol Weight 150.22 g/mol
Molecular Formula C10H14O
Exact Mass 150.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I6KlWkKVqqE
Name 4-Methyl-4-propyl-1-cyclohexa-2,5-dienone
Alternate Name(s) 4-Methyl-4-propyl-cyclohexa-2,5-dien-1-one
CAS Registry Number 61783-86-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O
InChI InChI=1S/C10H14O/c1-3-6-10(2)7-4-9(11)5-8-10/h4-5,7-8H,3,6H2,1-2H3
InChIKey PLOHYFCKPPQFOC-UHFFFAOYSA-N
Molecular Weight 150.221 g/mol
SMILES C=1C(C=CC(C1)=O)(CCC)C
SPLASH splash10-0a4i-0900000000-24682481f2c670270656
Source of Spectrum K-111-1957-0
Wiley ID 1147418