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(E)-5-Butyl-5-octen-2-one
SpectraBase Compound ID CyCIcJnhj25
InChI InChI=1S/C12H22O/c1-4-6-8-12(7-5-2)10-9-11(3)13/h7H,4-6,8-10H2,1-3H3/b12-7+
InChIKey XMNAIZUYTWHQFI-KPKJPENVSA-N
Mol Weight 182.31 g/mol
Molecular Formula C12H22O
Exact Mass 182.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 38CW0M72rIT
Name (E)-5-Butyl-5-octen-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O
InChI InChI=1S/C12H22O/c1-4-6-8-12(7-5-2)10-9-11(3)13/h7H,4-6,8-10H2,1-3H3/b12-7+
InChIKey XMNAIZUYTWHQFI-KPKJPENVSA-N
Molecular Weight 182.307 g/mol
SMILES C(\C=C\(CCC(=O)C)CCCC)C
SPLASH splash10-001i-9200000000-d9b0706b7b956935b563
Source of Spectrum KC-57-9120-6
Synonyms (5E)-5-butyl-5-octen-2-one
Wiley ID 1626376