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3-Hydroxy-3-methyl-glutaric acid dimethyl ester
SpectraBase Compound ID G83QZe5WDNk
InChI InChI=1S/C8H14O5/c1-8(11,4-6(9)12-2)5-7(10)13-3/h11H,4-5H2,1-3H3
InChIKey ANEMYUYZEOZEJW-UHFFFAOYSA-N
Mol Weight 190.19 g/mol
Molecular Formula C8H14O5
Exact Mass 190.084124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GokQE4shXLb
Name 3-Hydroxy-3-methyl-glutaric acid dimethyl ester
CAS Registry Number 56652-39-2
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O5
InChI InChI=1S/C8H14O5/c1-8(11,4-6(9)12-2)5-7(10)13-3/h11H,4-5H2,1-3H3
InChIKey ANEMYUYZEOZEJW-UHFFFAOYSA-N
Molecular Weight 190.195 g/mol
SMILES OC(CC(OC)=O)(C)CC(OC)=O
SPLASH splash10-0006-9300000000-73c836f59ffc003c24a2
Source of Spectrum NP-17-7983-0
Synonyms Dimethyl 3-hydroxy-3-methylpentane-1,5-dioate 3-Hydroxy-3-methylpentanedioic acid dimethyl ester Dimethyl 3-hydroxy-3-methyl-pentanedioate Dimethyl 3-hydroxy-3-methylglutarate Pentanedioic acid, 3-hydroxy-3-methyl-, dimethyl ester Dimethyl 3-methyl-3-oxidanyl-pentanedioate EINECS 260-314-0
Wiley ID 1102850