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trans,trans-2,4-Heptadienal
SpectraBase Compound ID LI1QarYMZXd
InChI InChI=1S/C7H10O/c1-2-3-4-5-6-7-8/h3-7H,2H2,1H3/b4-3+,6-5+
InChIKey SATICYYAWWYRAM-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 2oCc55FkgPg
Name trans-trans-2,4-Heptadienal
Classification Cigarettes additive
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 110.073164941 u
Formula C7H10O
InChI InChI=1S/C7H10O/c1-2-3-4-5-6-7-8/h3-7H,2H2,1H3/b4-3+,6-5+
InChIKey SATICYYAWWYRAM-VNKDHWASSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 110.156 g/mol
Nominal Mass 110 u
Quality 993
Retention Index 757
SMILES C(\C=C\C=C\CC)=O
SPLASH splash10-001i-9000000000-161caa7fc232be1bd12e
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms (2E,4E)-hepta-2,4-dienal
Technique GC/MS
Wiley ID DD2024_009680