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2-Methyl-3-[(E)-3-oxidanylidenebut-1-enyl]cyclohex-2-en-1-one
SpectraBase Compound ID UuznuxboF8
InChI InChI=1S/C11H14O2/c1-8(12)6-7-10-4-3-5-11(13)9(10)2/h6-7H,3-5H2,1-2H3/b7-6+
InChIKey VESTZYWHHLOJAD-VOTSOKGWSA-N
Mol Weight 178.23 g/mol
Molecular Formula C11H14O2
Exact Mass 178.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BA8qW9jW1jX
Name 2-Methyl-3-[(E)-3-oxidanylidenebut-1-enyl]cyclohex-2-en-1-one
CAS Registry Number 108946-93-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O2
InChI InChI=1S/C11H14O2/c1-8(12)6-7-10-4-3-5-11(13)9(10)2/h6-7H,3-5H2,1-2H3/b7-6+
InChIKey VESTZYWHHLOJAD-VOTSOKGWSA-N
Molecular Weight 178.231 g/mol
SMILES C1(=C(\C=C\C(=O)C)CCCC1=O)C
SPLASH splash10-0a73-2900000000-3d88048f4bc75188febb
Source of Spectrum K-120-1148-32
Synonyms 2-Methyl-3-[(E)-3-oxobut-1-enyl]-1-cyclohex-2-enone 2-Methyl-3-[(E)-3-oxobut-1-enyl]cyclohex-2-en-1-one 3-[(E)-3-ketobut-1-enyl]-2-methyl-cyclohex-2-en-1-one
Wiley ID 1174359