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1-[(E)-3-ketobut-1-enyl]-2,2-dimethyl-cyclopentanecarbaldehyde
SpectraBase Compound ID ARN4vMWJ808
InChI InChI=1S/C12H18O2/c1-10(14)5-8-12(9-13)7-4-6-11(12,2)3/h5,8-9H,4,6-7H2,1-3H3/b8-5+
InChIKey VCTNALRQYVRWHL-VMPITWQZSA-N
Mol Weight 194.27 g/mol
Molecular Formula C12H18O2
Exact Mass 194.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J4bCbuVvz4v
Name 1-[(E)-3-ketobut-1-enyl]-2,2-dimethyl-cyclopentanecarbaldehyde
Alternate Name(s) 2,2-Dimethyl-1-(3-oxo-but-1-enyl)-cyclopentanecarboxaldehyde 2,2-Dimethyl-1-[(1E)-3-oxo-1-butenyl]cyclopentanecarbaldehyde 2,2-Dimethyl-1-[(E)-3-oxidanylidenebut-1-enyl]cyclopentane-1-carbaldehyde 2,2-Dimethyl-1-[(E)-3-oxobut-1-enyl]-1-cyclopentanecarboxaldehyde 2,2-Dimethyl-1-[(E)-3-oxobut-1-enyl]cyclopentane-1-carbaldehyde 2,2-Dimethyl-1-[(E)-3-oxobut-1-enyl]cyclopentanecarbaldehyde
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Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-10(14)5-8-12(9-13)7-4-6-11(12,2)3/h5,8-9H,4,6-7H2,1-3H3/b8-5+
InChIKey VCTNALRQYVRWHL-VMPITWQZSA-N
Molecular Weight 194.274 g/mol
SMILES C1(\C=C\C(=O)C)(C(CCC1)(C)C)C=O
SPLASH splash10-002f-9700000000-91db5524d46f91c11ec5
Wiley ID 1487067