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(E)-1-(3,5,5-trimethyl-1-cyclohexenyl)-2-buten-1-one
SpectraBase Compound ID 9XT4vKKQs8e
InChI InChI=1S/C13H20O/c1-5-6-12(14)11-7-10(2)8-13(3,4)9-11/h5-7,10H,8-9H2,1-4H3/b6-5+
InChIKey YYXVTGCTXGBTLF-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 W9brylQF5w
Name (E)-1-(3,5,5-trimethyl-1-cyclohexenyl)-2-buten-1-one
Alternate Name(s) (E)-1-(3,5,5-trimethylcyclohexen-1-yl)but-2-en-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/h5-7,10H,8-9H2,1-4H3/b6-5+
InChIKey YYXVTGCTXGBTLF-AATRIKPKSA-N
Molecular Weight 192.302 g/mol
SMILES C1(=CC(C)CC(C1)(C)C)C(\C=C\C)=O
SPLASH splash10-014i-9300000000-5eca0a160ad6ccaeb06c
Source of Spectrum U-1996-813-19
Wiley ID 768423