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Propanedioic acid, (4-methoxy-3-methylphenyl)methyl-, diethyl ester
SpectraBase Compound ID JbxRHFSosvi
InChI InChI=1S/C16H22O5/c1-6-20-14(17)16(4,15(18)21-7-2)12-8-9-13(19-5)11(3)10-12/h8-10H,6-7H2,1-5H3
InChIKey LQBHXMDATGZVSR-UHFFFAOYSA-N
Mol Weight 294.35 g/mol
Molecular Formula C16H22O5
Exact Mass 294.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 294X5KX65Gg
Name Propanedioic acid, (4-methoxy-3-methylphenyl)methyl-, diethyl ester
Alternate Name(s) Diethyl (4-methoxy-3-methylphenyl)methylpropanedioate diethyl 2-(4-methoxy-3-methylphenyl)-2-methylmalonate
CAS Registry Number 83026-46-4
Comments Less than 3 mono-isotopic peaks
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Formula C16H22O5
InChI InChI=1S/C16H22O5/c1-6-20-14(17)16(4,15(18)21-7-2)12-8-9-13(19-5)11(3)10-12/h8-10H,6-7H2,1-5H3
InChIKey LQBHXMDATGZVSR-UHFFFAOYSA-N
Molecular Weight 294.347 g/mol
SMILES C(c1cc(C)c(cc1)OC)(C(=O)OCC)(C(=O)OCC)C
SPLASH splash10-0002-0920000000-db22595fe209cca2a4fe
Source of Spectrum J-47-4700-0
Wiley ID 1297123