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trans,trans-2,4-heptadienoic acid
SpectraBase Compound ID 9zQEmJrqec9
InChI InChI=1S/C7H10O2/c1-2-3-4-5-6-7(8)9/h3-6H,2H2,1H3,(H,8,9)/b4-3+,6-5+
InChIKey GYTGOLDQGRPDNF-VNKDHWASSA-N
Mol Weight 126.15 g/mol
Molecular Formula C7H10O2
Exact Mass 126.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IF5AyyiLrV4
Name trans,trans-2,4-heptadienoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H10O2
InChI InChI=1S/C7H10O2/c1-2-3-4-5-6-7(8)9/h3-6H,2H2,1H3,(H,8,9)/b4-3+,6-5+
InChIKey GYTGOLDQGRPDNF-VNKDHWASSA-N
Instrument Name Shimadzu GCMS-QP2010
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202200381
Molecular Weight 126.155 g/mol
SMILES OC(\C=C\C=C\CC)=O
SPLASH splash10-0ftb-9000000000-9185c2d639a309ea275b
Source of Spectrum ASC-364-SM20-4c
Wiley ID 1868536