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2-isopropenyl-4,4-dimethyl-cyclobut-2-en-1-one
SpectraBase Compound ID 55mJz4dqgjR
InChI InChI=1S/C9H12O/c1-6(2)7-5-9(3,4)8(7)10/h5H,1H2,2-4H3
InChIKey QHVDSNYEJAAXPP-UHFFFAOYSA-N
Mol Weight 136.19 g/mol
Molecular Formula C9H12O
Exact Mass 136.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GTZz6MDiCbm
Name 2-isopropenyl-4,4-dimethyl-cyclobut-2-en-1-one
CAS Registry Number 85219-33-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O
InChI InChI=1S/C9H12O/c1-6(2)7-5-9(3,4)8(7)10/h5H,1H2,2-4H3
InChIKey QHVDSNYEJAAXPP-UHFFFAOYSA-N
Molecular Weight 136.194 g/mol
SMILES C1(=CC(C1=O)(C)C)C(=C)C
SPLASH splash10-002u-9600000000-fb90a3db1e15eb05f9e9
Source of Spectrum H-65-2241-0
Synonyms 4,4-Dimethyl-2-(1-methylethenyl)-1-cyclobut-2-enone 4,4-Dimethyl-2-prop-1-en-2-yl-cyclobut-2-en-1-one
Wiley ID 1136228