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Butanedioic acid, 3-(acetyloxy)-2-hydroxy-2-(2-methylpropyl)-, dimethyl ester, [S-(R*,S*)]-
SpectraBase Compound ID KOxHaoXlMLp
InChI InChI=1S/C12H20O7/c1-7(2)6-12(16,11(15)18-5)9(10(14)17-4)19-8(3)13/h7,9,16H,6H2,1-5H3/t9-,12-/m0/s1
InChIKey PTOOBVJFERMYND-CABZTGNLSA-N
Mol Weight 276.28 g/mol
Molecular Formula C12H20O7
Exact Mass 276.120903 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3drsRLTue3g
Name Butanedioic acid, 3-(acetyloxy)-2-hydroxy-2-(2-methylpropyl)-, dimethyl ester, [S-(R*,S*)]-
CAS Registry Number 64381-67-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O7
InChI InChI=1S/C12H20O7/c1-7(2)6-12(16,11(15)18-5)9(10(14)17-4)19-8(3)13/h7,9,16H,6H2,1-5H3/t9-,12-/m0/s1
InChIKey PTOOBVJFERMYND-CABZTGNLSA-N
Molecular Weight 276.285 g/mol
SMILES O[C@@]([C@](C(=O)OC)(OC(=O)C)[H])(C(=O)OC)CC(C)C
SPLASH splash10-0f7x-6910000000-7e53a51e53152f8831eb
Source of Spectrum H-60-1310-0
Synonyms Dimethyl (2S,3R)-3-(acetyloxy)-2-hydroxy-2-isobutylbutanedioate Dimethyl(+,-)-o(3)-acetyl-2-isobutyl-erythro-tartrate
Wiley ID 1279669