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Z-3,4-Dimethyl-4-hexen-2-one
SpectraBase Compound ID GDsGnpOjv9F
InChI InChI=1S/C8H14O/c1-5-6(2)7(3)8(4)9/h5,7H,1-4H3/b6-5+
InChIKey JREXONVOTZQSLT-AATRIKPKSA-N
Mol Weight 126.2 g/mol
Molecular Formula C8H14O
Exact Mass 126.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1JCtWieLWO8
Name (4E)-3,4-Dimethyl-4-hexen-2-one
CAS Registry Number 53252-21-4
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O
InChI InChI=1S/C8H14O/c1-5-6(2)7(3)8(4)9/h5,7H,1-4H3/b6-5+
InChIKey JREXONVOTZQSLT-AATRIKPKSA-N
Molecular Weight 126.199 g/mol
SMILES CC(C(C)=O)\C(C)=C\C
SPLASH splash10-052f-9000000000-e76aae1a700c63ff4de5
Source of Spectrum HE-1982-0-0
Synonyms (E)-3,4-dimethyl-4-hexen-2-one (E)-3,4-dimethylhex-4-en-2-one 3,4-Dimethyl-4-hexen-2-one 4-Hexen-2-one, 3,4-dimethyl-
Wiley ID 1130122