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HEPTA-3,5-DIEN-2-ONE
SpectraBase Compound ID 1iZ4rF2mJN1
InChI InChI=1S/C7H10O/c1-3-4-5-6-7(2)8/h3-6H,1-2H3/b4-3+,6-5+
InChIKey SWGLACWOVFCDQS-VNKDHWASSA-N
Mol Weight 110.16 g/mol
Molecular Formula C7H10O
Exact Mass 110.073165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1M8owUnQrg
Name (3E,5E)-Hepta-3,5-dien-2-one
CAS Registry Number 18402-90-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H10O
InChI InChI=1S/C7H10O/c1-3-4-5-6-7(2)8/h3-6H,1-2H3/b4-3+,6-5+
InChIKey SWGLACWOVFCDQS-VNKDHWASSA-N
Molecular Weight 110.156 g/mol
SMILES C\C=C\C=C\C(=O)C
SPLASH splash10-00kb-9200000000-a5bf5bdab2318dd897cd
Source of Spectrum KC-0-3303-2
Synonyms (3E,5E)-3,5-Heptadien-2-one (3E,5E)-2-hepta-3,5-dienone trans,trans-3,5-Heptadien-2-one
Wiley ID 823813