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2,4-Dihydroxy-3,6-dimethyl-benzoic acid
SpectraBase Compound ID JTyrLR9MpAv
InChI InChI=1S/C9H10O4/c1-4-3-6(10)5(2)8(11)7(4)9(12)13/h3,10-11H,1-2H3,(H,12,13)
InChIKey VHNLJRRECIZZPX-UHFFFAOYSA-N
Mol Weight 182.17 g/mol
Molecular Formula C9H10O4
Exact Mass 182.057909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AznePWbYRw8
Name 2,4-Dihydroxy-3,6-dimethyl-benzoic acid
Alternate Name(s) 3,6-Dimethyl-2,4-bis(oxidanyl)benzoic acid 3-Methylorsellinic acid
CAS Registry Number 4707-46-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10O4
InChI InChI=1S/C9H10O4/c1-4-3-6(10)5(2)8(11)7(4)9(12)13/h3,10-11H,1-2H3,(H,12,13)
InChIKey VHNLJRRECIZZPX-UHFFFAOYSA-N
Molecular Weight 182.175 g/mol
SMILES Oc1c(c(c(C(=O)O)c(c1)C)O)C
SPLASH splash10-01p9-1900000000-f581d8ac72be20841283
Source of Spectrum C-98-7740-0
Wiley ID 1178133