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1-Cyclopropyl-2,4-hexadien-1-one
SpectraBase Compound ID HgTquXliTS0
InChI InChI=1S/C9H12O/c1-2-3-4-5-9(10)8-6-7-8/h2-5,8H,6-7H2,1H3/b3-2+,5-4+
InChIKey XVBPHYXYSOAMEK-MQQKCMAXSA-N
Mol Weight 136.19 g/mol
Molecular Formula C9H12O
Exact Mass 136.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2L9Z22ZKCuJ
Name 1-Cyclopropyl-2,4-hexadien-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O
InChI InChI=1S/C9H12O/c1-2-3-4-5-9(10)8-6-7-8/h2-5,8H,6-7H2,1H3/b3-2+,5-4+
InChIKey XVBPHYXYSOAMEK-MQQKCMAXSA-N
Molecular Weight 136.194 g/mol
SMILES C(\C=C\C=C\C)(=O)C1CC1
SPLASH splash10-01ba-9500000000-ecc7ce31d2d34d95138d
Source of Spectrum F9-1990-2032-0
Synonyms (2E,4E)-1-cyclopropyl-2,4-hexadien-1-one
Wiley ID 1566286