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1-Hexen-3-one
SpectraBase Compound ID EkFvck6aSI6
InChI InChI=1S/C6H10O/c1-3-5-6(7)4-2/h4H,2-3,5H2,1H3
InChIKey JTHNLKXLWOXOQK-UHFFFAOYSA-N
Mol Weight 98.14 g/mol
Molecular Formula C6H10O
Exact Mass 98.073165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LivuexUrnec
Name hex-1-en-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H10O
InChI InChI=1S/C6H10O/c1-3-5-6(7)4-2/h4H,2-3,5H2,1H3
InChIKey JTHNLKXLWOXOQK-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/cctc.202002011
Molecular Weight 98.145 g/mol
SMILES CCCC(C=C)=O
SPLASH splash10-0a4l-9000000000-f2be27e3077eb798df5c
Source of Spectrum CCC-13-SM15-3
Wiley ID 1854345