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2-Butenedioic acid, 2-methyl-, diethyl ester, (Z)-
SpectraBase Compound ID 9fGkpcQfZLt
InChI InChI=1S/C9H14O4/c1-4-12-8(10)6-7(3)9(11)13-5-2/h6H,4-5H2,1-3H3/b7-6-
InChIKey YPTLFOZCUOHVFO-SREVYHEPSA-N
Mol Weight 186.21 g/mol
Molecular Formula C9H14O4
Exact Mass 186.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JFPAPhWJEAT
Name 2-Butenedioic acid, 2-methyl-, diethyl ester, (Z)-
CAS Registry Number 691-83-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O4
InChI InChI=1S/C9H14O4/c1-4-12-8(10)6-7(3)9(11)13-5-2/h6H,4-5H2,1-3H3/b7-6-
InChIKey YPTLFOZCUOHVFO-SREVYHEPSA-N
Molecular Weight 186.207 g/mol
SMILES C(\C=C/(C(=O)OCC)C)(=O)OCC
SPLASH splash10-03dl-0900000000-7b69a3f78d0b653b3bd0
Source of Spectrum O-21-225-1
Synonyms Diethyl ester of methylmaleic acid Citraconic acid, diethyl ester Diethyl (2Z)-2-methyl-2-butenedioate Diethyl citraconate Diethyl methylmaleate (Z)-2-methyl-2-butenedioic acid diethyl ester Diethyl (Z)-2-methylbut-2-enedioate
Wiley ID 1182546