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(E)-4,5,5-trimethyl-3-hexen-2-one
SpectraBase Compound ID G22s3F5V3qC
InChI InChI=1S/C9H16O/c1-7(6-8(2)10)9(3,4)5/h6H,1-5H3/b7-6+
InChIKey LPARYLNSXBSISE-VOTSOKGWSA-N
Mol Weight 140.23 g/mol
Molecular Formula C9H16O
Exact Mass 140.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4IE06hEJXs
Name (E)-4,5,5-trimethyl-3-hexen-2-one
CAS Registry Number 23732-21-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O
InChI InChI=1S/C9H16O/c1-7(6-8(2)10)9(3,4)5/h6H,1-5H3/b7-6+
InChIKey LPARYLNSXBSISE-VOTSOKGWSA-N
Molecular Weight 140.226 g/mol
SMILES C(\C=C\(C(C)(C)C)C)(=O)C
SPLASH splash10-0a6r-9600000000-a824a2dfe00718a441a4
Source of Spectrum C-97-4023-0
Synonyms (E)-4,5,5-Trimethylhex-3-en-2-one
Wiley ID 1139629