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2-Hydroxy-3-methyl-succinic acid dimethyl ester
SpectraBase Compound ID Eez8ogXeVd2
InChI InChI=1S/C7H12O5/c1-4(6(9)11-2)5(8)7(10)12-3/h4-5,8H,1-3H3
InChIKey RUUHUDXJDHEPBZ-UHFFFAOYSA-N
Mol Weight 176.17 g/mol
Molecular Formula C7H12O5
Exact Mass 176.068473 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 20GxUUdClUn
Name 2-Hydroxy-3-methyl-succinic acid dimethyl ester
Alternate Name(s) Dimethyl 2-hydroxy-3-methylsuccinate 2-Hydroxy-3-methylbutanedioic acid dimethyl ester Butanedioic acid, 2-hydroxy-3-methyl-, dimethyl ester Dimethyl 2-hydroxy-3-methyl-butanedioate Dimethyl 2-methyl-3-oxidanyl-butanedioate
CAS Registry Number 50460-80-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O5
InChI InChI=1S/C7H12O5/c1-4(6(9)11-2)5(8)7(10)12-3/h4-5,8H,1-3H3
InChIKey RUUHUDXJDHEPBZ-UHFFFAOYSA-N
Molecular Weight 176.168 g/mol
SMILES OC(C(OC)=O)C(C)C(=O)OC
SPLASH splash10-0a4r-9100000000-019c5a3bfaa8ee12ea03
Source of Spectrum HE-1986-1906-0
Wiley ID 1171937