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CLAVATOIC-ACID;3-ACETYL-2,6-DIHYDROXY-5-METHYLBENZOIC-ACID
SpectraBase Compound ID GYE6RdFLMHc
InChI InChI=1S/C10H10O5/c1-4-3-6(5(2)11)9(13)7(8(4)12)10(14)15/h3,12-13H,1-2H3,(H,14,15)
InChIKey NIVOTSZWKATDPU-UHFFFAOYSA-N
Mol Weight 210.18 g/mol
Molecular Formula C10H10O5
Exact Mass 210.052823 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IS99NlNfxY4
Name 3-acetyl-2,6-dihydroxy-5-methylbenzoic acid
Appearance Pale yellow needles
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10O5
InChI InChI=1S/C10H10O5/c1-4-3-6(5(2)11)9(13)7(8(4)12)10(14)15/h3,12-13H,1-2H3,(H,14,15)
InChIKey NIVOTSZWKATDPU-UHFFFAOYSA-N
Instrument Name HITACHI M80
Ionization Type EI
Literature Reference DOI 10.1021/np010600r
Molecular Weight 210.185 g/mol
SMILES Oc1c(cc(c(c1C(O)=O)O)C)C(=O)C
SPLASH splash10-03fu-1910000000-9d7033187ad8395ff340
Source of Spectrum G4-65-623-3
Synonyms Clavatoic acid
Wiley ID 1883631