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2-(3,5-dihydroxyphenyl)acetic acid
SpectraBase Compound ID BW8fR9TU8mw
InChI InChI=1S/C8H8O4/c9-6-1-5(3-8(11)12)2-7(10)4-6/h1-2,4,9-10H,3H2,(H,11,12)
InChIKey IOVOJJDSFSXJQN-UHFFFAOYSA-N
Mol Weight 168.15 g/mol
Molecular Formula C8H8O4
Exact Mass 168.042259 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D8oCeI0YuRu
Name 3,5-Dihydroxyphenylacetic acid
Alternate Name(s) 2-(3,5-dihydroxyphenyl)acetic acid 2-[3,5-bis(oxidanyl)phenyl]ethanoic acid
CAS Registry Number 4670-09-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8O4
InChI InChI=1S/C8H8O4/c9-6-1-5(3-8(11)12)2-7(10)4-6/h1-2,4,9-10H,3H2,(H,11,12)
InChIKey IOVOJJDSFSXJQN-UHFFFAOYSA-N
Molecular Weight 168.148 g/mol
SMILES Oc1cc(cc(c1)O)CC(=O)O
SPLASH splash10-00xr-4900000000-f1516b5a0c0adbeafa84
Wiley ID 1483910