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2-Pentenoic acid, 3-methyl-, methyl ester, (E)-
SpectraBase Compound ID I9V4BypR5pT
InChI InChI=1S/C7H12O2/c1-4-6(2)5-7(8)9-3/h5H,4H2,1-3H3/b6-5+
InChIKey SLQFYMAWZYTVFZ-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 H2fsAfzb4ca
Name 2-Pentenoic acid, 3-methyl-, methyl ester, (E)-
CAS Registry Number 17447-01-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O2
InChI InChI=1S/C7H12O2/c1-4-6(2)5-7(8)9-3/h5H,4H2,1-3H3/b6-5+
InChIKey SLQFYMAWZYTVFZ-AATRIKPKSA-N
Molecular Weight 128.171 g/mol
SMILES C(\C=C\(CC)C)(=O)OC
SPLASH splash10-0f6t-9000000000-76dff4aa05133a446497
Source of Spectrum J-50-3534-15
Synonyms 2-Pentenoic acid, 3-methyl-, methyl ester (E)-3-methyl-2-pentenoic acid methyl ester (E)-3-methylpent-2-enoic acid methyl ester Methyl (2E)-3-methyl-2-pentenoate Methyl (E)-3-methylpent-2-enoate Methyl 3-methyl-2-pentenoate
Wiley ID 1131362