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2,4-Dihydroxybenzoic acid, trihydrate

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2,4-Dihydroxybenzoic acid, trihydrate
SpectraBase Compound ID 6wRnq2Ldtrz
InChI InChI=1S/C7H6O4.3H2O/c8-4-1-2-5(7(10)11)6(9)3-4;;;/h1-3,8-9H,(H,10,11);3*1H2
InChIKey RTBSPUJKJMTGTQ-UHFFFAOYSA-N
Mol Weight 208.166 g/mol
Molecular Formula C7H12O7
Exact Mass 208.058303 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7CGOt5Qvif2
Name beta-RESORCYLIC ACID, TRIHYDRATE
Source of Sample Koppers Company, Inc., Pittsburgh, Pennsylvania
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H6O4 3H2O
InChI InChI=1S/C7H6O4.3H2O/c8-4-1-2-5(7(10)11)6(9)3-4;;;/h1-3,8-9H,(H,10,11);3*1H2
InChIKey RTBSPUJKJMTGTQ-UHFFFAOYSA-N
Melting Point 206C
Molecular Weight 208.17
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms BENZOIC ACID, 2,4-DIHYDROXY-, TRIHYDRATE B-RESORCYLIC ACID, TRIHYDRATE