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(E)-2-hexenedioic acid dimethyl ester
SpectraBase Compound ID InCc4jbxNGk
InChI InChI=1S/C8H12O4/c1-11-7(9)5-3-4-6-8(10)12-2/h3,5H,4,6H2,1-2H3/b5-3+
InChIKey QPFMISCWBTXLFC-HWKANZROSA-N
Mol Weight 172.18 g/mol
Molecular Formula C8H12O4
Exact Mass 172.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 66BENTitzDn
Name (E)-2-hexenedioic acid dimethyl ester
CAS Registry Number 70353-99-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12O4
InChI InChI=1S/C8H12O4/c1-11-7(9)5-3-4-6-8(10)12-2/h3,5H,4,6H2,1-2H3/b5-3+
InChIKey QPFMISCWBTXLFC-HWKANZROSA-N
Molecular Weight 172.180 g/mol
SMILES C(\C=C\CCC(=O)OC)(=O)OC
SPLASH splash10-0536-2900000000-f11a3eb5e8500bd97f78
Source of Spectrum U-1994-887-2
Synonyms Dimethyl (2E)-2-hexenedioate (E)-hex-2-enedioic acid dimethyl ester 2-Hexenedioic acid, dimethyl ester, (E)- Dimethyl (E)-hex-2-enedioate
Wiley ID 766021