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(E)-1-(3,5,5-trimethyl-1-cyclohex-2-enyl)-2-buten-1-one
SpectraBase Compound ID ACkrySvGaFr
InChI InChI=1S/C13H20O/c1-5-6-12(14)11-7-10(2)8-13(3,4)9-11/h5-7,11H,8-9H2,1-4H3/b6-5+
InChIKey JPQKROBNQTWSRG-AATRIKPKSA-N
Mol Weight 192.3 g/mol
Molecular Formula C13H20O
Exact Mass 192.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Djr55yeOzC
Name (E)-1-(3,5,5-trimethyl-1-cyclohex-2-enyl)-2-buten-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O
InChI InChI=1S/C13H20O/c1-5-6-12(14)11-7-10(2)8-13(3,4)9-11/h5-7,11H,8-9H2,1-4H3/b6-5+
InChIKey JPQKROBNQTWSRG-AATRIKPKSA-N
Molecular Weight 192.302 g/mol
SMILES C=1C(C(\C=C\C)=O)CC(CC1C)(C)C
SPLASH splash10-0597-7900000000-6bf5ff79fed7060c7355
Source of Spectrum U-1996-813-0
Synonyms (E)-1-(3,5,5-trimethylcyclohex-2-en-1-yl)but-2-en-1-one
Wiley ID 768424