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Methyl 3-(3,4-dihydroxyphenyl)-3-hydroxypropanoate
SpectraBase Compound ID HMzZ8XavsHY
InChI InChI=1S/C10H12O5/c1-15-10(14)5-8(12)6-2-3-7(11)9(13)4-6/h2-4,8,11-13H,5H2,1H3
InChIKey UANTXCOQIZBHAA-UHFFFAOYSA-N
Mol Weight 212.2 g/mol
Molecular Formula C10H12O5
Exact Mass 212.068473 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 45YhKB2mK97
Name Methyl 3-(3,4-dihydroxyphenyl)-3-hydroxypropanoate
CAS Registry Number 113274-42-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O5
InChI InChI=1S/C10H12O5/c1-15-10(14)5-8(12)6-2-3-7(11)9(13)4-6/h2-4,8,11-13H,5H2,1H3
InChIKey UANTXCOQIZBHAA-UHFFFAOYSA-N
Molecular Weight 212.201 g/mol
SMILES Oc1cc(ccc1O)C(CC(=O)OC)O
SPLASH splash10-01p9-0910000000-b02d10ea1fd13fcec456
Source of Spectrum J-53-1540-32
Synonyms 3-(3,4-dihydroxyphenyl)-3-hydroxypropanoic acid methyl ester Methyl 3-(3,4-dihydroxyphenyl)-3-hydroxy-propanoate Methyl 3-[3,4-bis(oxidanyl)phenyl]-3-oxidanyl-propanoate
Wiley ID 1210995