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(E)-4,4-dimethyl-2-pentenoic acid
SpectraBase Compound ID 3e588GKxbbq
InChI InChI=1S/C7H12O2/c1-7(2,3)5-4-6(8)9/h4-5H,1-3H3,(H,8,9)/b5-4+
InChIKey RPVPMVHPERYZNF-SNAWJCMRSA-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 5APxo9TuIS
Name (E)-4,4-dimethyl-2-pentenoic acid
CAS Registry Number 101225-66-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O2
InChI InChI=1S/C7H12O2/c1-7(2,3)5-4-6(8)9/h4-5H,1-3H3,(H,8,9)/b5-4+
InChIKey RPVPMVHPERYZNF-SNAWJCMRSA-N
Molecular Weight 128.171 g/mol
SMILES OC(\C=C\C(C)(C)C)=O
SPLASH splash10-01q9-7900000000-53d4ae9ac7a0c1a7b1d3
Source of Spectrum J-51-1655-14
Synonyms (E)-4,4-dimethylpent-2-enoic acid
Wiley ID 1131366