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2-Butenedioic acid, 2-(4-methyl-3-pentenyl)-, diethyl ester, (E)-
SpectraBase Compound ID Lt64Dt1AxEy
InChI InChI=1S/C14H22O4/c1-5-17-13(15)10-12(14(16)18-6-2)9-7-8-11(3)4/h8,10H,5-7,9H2,1-4H3/b12-10+
InChIKey ZBWDOSGLDFPJJV-ZRDIBKRKSA-N
Mol Weight 254.33 g/mol
Molecular Formula C14H22O4
Exact Mass 254.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ucy0HOEZ4j
Name 2-Butenedioic acid, 2-(4-methyl-3-pentenyl)-, diethyl ester, (E)-
CAS Registry Number 100582-42-1
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O4
InChI InChI=1S/C14H22O4/c1-5-17-13(15)10-12(14(16)18-6-2)9-7-8-11(3)4/h8,10H,5-7,9H2,1-4H3/b12-10+
InChIKey ZBWDOSGLDFPJJV-ZRDIBKRKSA-N
Molecular Weight 254.326 g/mol
SMILES C(\C=C\(C(=O)OCC)CCC=C(C)C)(=O)OCC
SPLASH splash10-014i-9700000000-30e1f31edec39046fb17
Source of Spectrum KC-1985-1591-6
Synonyms (2E)-ethyl 3-ethoxycarbonyl-7-methylocta-2,6-dienoate Diethyl (2E)-2-(4-methyl-3-pentenyl)-2-butenedioate
Wiley ID 1257713