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2,4-Heptadien-6-ynal, 7-phenyl-, (Z,E)-
SpectraBase Compound ID GykV1JzF4f0
InChI InChI=1S/C13H10O/c14-12-8-3-1-2-5-9-13-10-6-4-7-11-13/h1-4,6-8,10-12H/b2-1+,8-3-
InChIKey ZUBNTDFDRXTHFT-PKTZTGOHSA-N
Mol Weight 182.22 g/mol
Molecular Formula C13H10O
Exact Mass 182.073165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dwlj0ybcLLy
Name 2,4-Heptadien-6-ynal, 7-phenyl-, (Z,E)-
CAS Registry Number 99237-58-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10O
InChI InChI=1S/C13H10O/c14-12-8-3-1-2-5-9-13-10-6-4-7-11-13/h1-4,6-8,10-12H/b2-1+,8-3-
InChIKey ZUBNTDFDRXTHFT-PKTZTGOHSA-N
Molecular Weight 182.222 g/mol
SMILES C(#Cc1ccccc1)\C=C\C=C/C=O
SPLASH splash10-0ue9-0900000000-4ec88773c30d46856185
Source of Spectrum KC-1989-687-3
Synonyms (2Z,4E)-7-phenyl-2,4-heptadien-6-ynal (2Z,4E)-7-phenylhepta-2,4-dien-6-ynal
Wiley ID 1179270