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4-Isopropyl-1,3-cyclohexanedione
SpectraBase Compound ID Juskbp4KYgi
InChI InChI=1S/C9H14O2/c1-6(2)8-4-3-7(10)5-9(8)11/h6,8H,3-5H2,1-2H3
InChIKey IBNLVXNNYIGLLB-UHFFFAOYSA-N
Mol Weight 154.21 g/mol
Molecular Formula C9H14O2
Exact Mass 154.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ByVfnR3y35f
Name 4-Isopropyl-1,3-cyclohexanedione
CAS Registry Number 62831-62-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O2
InChI InChI=1S/C9H14O2/c1-6(2)8-4-3-7(10)5-9(8)11/h6,8H,3-5H2,1-2H3
InChIKey IBNLVXNNYIGLLB-UHFFFAOYSA-N
Molecular Weight 154.209 g/mol
SMILES C1CC(CC(C1C(C)C)=O)=O
SPLASH splash10-05nf-9100000000-13564ab5a80722a868c1
Source of Spectrum PR-28-0-0
Synonyms 4-isopropylcyclohexane-1,3-dione 4-isopropylcyclohexane-1,3-quinone 4-Propan-2-ylcyclohexane-1,3-dione
Wiley ID 1151363