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Dimethyl (R)-(+)-methylsuccinate
SpectraBase Compound ID LvQ0GVOa7S6
InChI InChI=1S/C7H12O4/c1-5(7(9)11-3)4-6(8)10-2/h5H,4H2,1-3H3/t5-/m1/s1
InChIKey NFOQJNGQQXICBY-RXMQYKEDSA-N
Mol Weight 160.17 g/mol
Molecular Formula C7H12O4
Exact Mass 160.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cx5vz6wcpXP
Name (2R)-2-methylbutanedioic acid dimethyl ester
Alternate Name(s) (2R)-2-methylsuccinic acid dimethyl ester dimethyl (2R)-2-methylbutanedioate
CAS Registry Number 22644-27-5
Comments Removed - expert review: contamination (air); A corrected record has been addded having SpectrumID: 1821010
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O4
InChI InChI=1S/C7H12O4/c1-5(7(9)11-3)4-6(8)10-2/h5H,4H2,1-3H3/t5-/m1/s1
InChIKey NFOQJNGQQXICBY-RXMQYKEDSA-N
Molecular Weight 160.169 g/mol
SMILES C([C@@](CC(=O)OC)(C)[H])(=O)OC
SPLASH splash10-004i-9200000000-44e7842dc6c51230ac19
Source of Spectrum H-69-1831-2
Wiley ID 1156583