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6-chloro-4-quinolinol, hemihydrate

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6-chloro-4-quinolinol, hemihydrate
SpectraBase Compound ID 3JYAy4HnUkP
InChI InChI=1S/2C9H6ClNO.H2O/c2*10-6-1-2-8-7(5-6)9(12)3-4-11-8;/h2*1-5H,(H,11,12);1H2
InChIKey MRHRKKVMJAOZFA-UHFFFAOYSA-N
Mol Weight 188.613 g/mol
Molecular Formula C9H6ClNO·½H2O
Exact Mass 188.019074 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 699Oesq60z2
Name 6-CHLORO-4-QUINOLINOL, HEMIHYDRATE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H6ClNO 1/2H2O
InChI InChI=1S/2C9H6ClNO.H2O/c2*10-6-1-2-8-7(5-6)9(12)3-4-11-8;/h2*1-5H,(H,11,12);1H2
InChIKey MRHRKKVMJAOZFA-UHFFFAOYSA-N
Molecular Weight 188.61
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms 4-QUINOLINOL, 6-CHLORO-, HEMIHYDRATE