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2-Pentenoic acid, 4,4-dimethoxy-, methyl ester, (E)-
SpectraBase Compound ID AKerstOuYGU
InChI InChI=1S/C8H14O4/c1-8(11-3,12-4)6-5-7(9)10-2/h5-6H,1-4H3/b6-5+
InChIKey ITHKHLNISGKTBY-AATRIKPKSA-N
Mol Weight 174.2 g/mol
Molecular Formula C8H14O4
Exact Mass 174.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8xpME3pk6H2
Name 2-Pentenoic acid, 4,4-dimethoxy-, methyl ester, (E)-
CAS Registry Number 42997-93-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O4
InChI InChI=1S/C8H14O4/c1-8(11-3,12-4)6-5-7(9)10-2/h5-6H,1-4H3/b6-5+
InChIKey ITHKHLNISGKTBY-AATRIKPKSA-N
Molecular Weight 174.196 g/mol
SMILES COC(=O)\C=C\C(C)(OC)OC
SPLASH splash10-0007-4900000000-44f94c17d1d8142f014d
Source of Spectrum W5-11448-0-0
Synonyms Methyl (2E)-4,4-dimethoxy-2-pentenoate (E)-4,4-dimethoxy-2-pentenoic acid methyl ester (E)-4,4-dimethoxypent-2-enoic acid methyl ester Methyl (E)-4,4-dimethoxypent-2-enoate
Wiley ID 1170309