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Butanedioic acid, 2,3-dihydroxy-2-[(4-methoxyphenyl)methyl]-, dimethyl ester, [R-(R*,R*)]-
SpectraBase Compound ID 7BPDZy561q4
InChI InChI=1S/C14H18O7/c1-19-10-6-4-9(5-7-10)8-14(18,13(17)21-3)11(15)12(16)20-2/h4-7,11,15,18H,8H2,1-3H3/t11-,14+/m0/s1
InChIKey ZLMUPNCQNXLFEY-SMDDNHRTSA-N
Mol Weight 298.29 g/mol
Molecular Formula C14H18O7
Exact Mass 298.105253 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JpPpChgrvPr
Name Butanedioic acid, 2,3-dihydroxy-2-[(4-methoxyphenyl)methyl]-, dimethyl ester, [R-(R*,R*)]-
Alternate Name(s) (2R,3R)-2,3-dihydroxy-2-(4'-methoxybenzyl)butanedioic acid dimethylester Dimethyl (2R,3R)-2,3-dihydroxy-2-(4-methoxybenzyl)butanedioate
CAS Registry Number 79917-87-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O7
InChI InChI=1S/C14H18O7/c1-19-10-6-4-9(5-7-10)8-14(18,13(17)21-3)11(15)12(16)20-2/h4-7,11,15,18H,8H2,1-3H3/t11-,14+/m0/s1
InChIKey ZLMUPNCQNXLFEY-SMDDNHRTSA-N
Molecular Weight 298.291 g/mol
SMILES O[C@]([C@@](C(=O)OC)(Cc1ccc(cc1)OC)O)(C(=O)OC)[H]
SPLASH splash10-00di-1900000000-7b528ac0adcca993b1e8
Source of Spectrum H-70-1205-3
Wiley ID 1300659