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1-Benzyl 4-methyl (2Z)-2-butenedioate
SpectraBase Compound ID 7ZMINpuzJLj
InChI InChI=1S/C12H12O4/c1-15-11(13)7-8-12(14)16-9-10-5-3-2-4-6-10/h2-8H,9H2,1H3/b8-7-
InChIKey BMJXWTXRRZMGMV-FPLPWBNLSA-N
Mol Weight 220.22 g/mol
Molecular Formula C12H12O4
Exact Mass 220.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AjPepQG7yMI
Name 1-Benzyl 4-methyl (2Z)-2-butenedioate
CAS Registry Number 105113-83-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O4
InChI InChI=1S/C12H12O4/c1-15-11(13)7-8-12(14)16-9-10-5-3-2-4-6-10/h2-8H,9H2,1H3/b8-7-
InChIKey BMJXWTXRRZMGMV-FPLPWBNLSA-N
Molecular Weight 220.224 g/mol
SMILES COC(=O)\C=C/C(=O)OCc1ccccc1
SPLASH splash10-03dl-9600000000-452699d7fa02be28a556
Source of Spectrum JC-367-204-0
Synonyms (Z)-2-butenedioic acid O1-methyl ester O4-(phenylmethyl) ester (Z)-but-2-enedioic acid O4-benzyl ester O1-methyl ester 4-O-benzyl 1-O-methyl (Z)-but-2-enedioate Benzyl methyl maleate O1-methyl O4-(phenylmethyl) (Z)-but-2-enedioate O4-benzyl O1-methyl (Z)-but-2-enedioate
Wiley ID 1219681