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3-Methyl-glutaric acid, dimethyl ester
SpectraBase Compound ID DM6pDZ1QIX7
InChI InChI=1S/C8H14O4/c1-6(4-7(9)11-2)5-8(10)12-3/h6H,4-5H2,1-3H3
InChIKey YIJLMTNDXYVGPQ-UHFFFAOYSA-N
Mol Weight 174.2 g/mol
Molecular Formula C8H14O4
Exact Mass 174.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4oPhm53vtQN
Name Glutaric acid, 3-methyl-, dimethyl ester
CAS Registry Number 116415-47-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O4
InChI InChI=1S/C8H14O4/c1-6(4-7(9)11-2)5-8(10)12-3/h6H,4-5H2,1-3H3
InChIKey YIJLMTNDXYVGPQ-UHFFFAOYSA-N
Molecular Weight 174.196 g/mol
SMILES C(=O)(CC(CC(=O)OC)C)OC
SPLASH splash10-004i-0900000000-c236e0cf9c29e5f49084
Source of Spectrum F-44-122-2
Synonyms 3-Methylglutaric acid dimethyl ester Pentanedioic acid, 3-methyl-, dimethyl ester 3-Methylpentanedioic acid dimethyl ester Dimethyl 3-methylglutarate Dimethyl 3-methylpentanedioate Methyl 3-methylgutarate
Wiley ID 1233334