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trans-2-Heptenoic acid
SpectraBase Compound ID HvTxUqGGU4E
InChI InChI=1S/C7H12O2/c1-2-3-4-5-6-7(8)9/h5-6H,2-4H2,1H3,(H,8,9)/b6-5+
InChIKey YURNCBVQZBJDAJ-AATRIKPKSA-N
Mol Weight 128.17 g/mol
Molecular Formula C7H12O2
Exact Mass 128.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGhT8rL2u
Name 2-Heptenoic acid
CAS Registry Number 18999-28-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O2
InChI InChI=1S/C7H12O2/c1-2-3-4-5-6-7(8)9/h5-6H,2-4H2,1H3,(H,8,9)/b6-5+
InChIKey YURNCBVQZBJDAJ-AATRIKPKSA-N
Molecular Weight 128.171 g/mol
SMILES OC(\C=C\CCCC)=O
SPLASH splash10-054o-9000000000-7c5803699617a422e04b
Source of Spectrum LQ-1992-1786-0
Synonyms (2E)-2-Heptenoic acid (E)-2-heptenoic acid (E)-hept-2-enoic acid Ethyl 2-heptenoate Hept-2-enoic acid EINECS 242-738-8
Wiley ID 1131341