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FRELPDYZPNNWJO-UHFFFAOYSA-N
SpectraBase Compound ID AxGrwmkcdjL
InChI InChI=1S/C12H16O4/c1-8(12(13)14)4-9-5-10(15-2)7-11(6-9)16-3/h5-8H,4H2,1-3H3,(H,13,14)
InChIKey FRELPDYZPNNWJO-UHFFFAOYSA-N
Mol Weight 224.26 g/mol
Molecular Formula C12H16O4
Exact Mass 224.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DBbB4C4EcF9
Name 3-(3,5-dimethoxyphenyl)-2-methyl-propanoic acid
CAS Registry Number 122333-94-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O4
InChI InChI=1S/C12H16O4/c1-8(12(13)14)4-9-5-10(15-2)7-11(6-9)16-3/h5-8H,4H2,1-3H3,(H,13,14)
InChIKey FRELPDYZPNNWJO-UHFFFAOYSA-N
Molecular Weight 224.256 g/mol
SMILES OC(C(Cc1cc(OC)cc(c1)OC)C)=O
SPLASH splash10-0umi-0930000000-ba5de123289bbd487096
Source of Spectrum J-54-4219-5
Synonyms 3-(3,5-dimethoxyphenyl)-2-methyl-propionic acid
Wiley ID 1224998