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4-Heptenal, (Z)-

View entire compound with spectra: 4 FTIR, and 18 MS (GC)

4-Heptenal, (Z)-
SpectraBase Compound ID Ij54wApNtPv
InChI InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h3-4,7H,2,5-6H2,1H3/b4-3-
InChIKey VVGOCOMZRGWHPI-ARJAWSKDSA-N
Mol Weight 112.17 g/mol
Molecular Formula C7H12O
Exact Mass 112.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3HagiWNqFmJ
Name 4-HEPTENAL, (Z)-
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 112.088815005 u
Formula C7H12O
InChI InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h3-4,7H,2,5-6H2,1H3/b4-3-
InChIKey VVGOCOMZRGWHPI-ARJAWSKDSA-N
Molecular Weight 112.172 g/mol
Nominal Mass 112 u
Number of Peaks 64
SMILES CC\C=C/CCC=O
SPLASH splash10-00ou-9000000000-9a42dc4df44c335435ee
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany
Wiley ID MVX000553