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4-amino-1-naphthalenesulfonic acid, hydrate

View entire compound with spectra: 3 NMR, and 1 FTIR

4-amino-1-naphthalenesulfonic acid, hydrate
SpectraBase Compound ID DteTO56IEVV
InChI InChI=1S/C10H9NO3S.H2O/c11-9-5-6-10(15(12,13)14)8-4-2-1-3-7(8)9;/h1-6H,11H2,(H,12,13,14);1H2
InChIKey PQJWXZDNTYSZKW-UHFFFAOYSA-N
Mol Weight 241.261 g/mol
Molecular Formula C10H11NO4S
Exact Mass 241.040879 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 923KF4aC6OG
Name 4-AMINO-1-NAPHTHALENESULFONIC ACID, HYDRATE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9NO3S H2O
InChI InChI=1S/C10H9NO3S.H2O/c11-9-5-6-10(15(12,13)14)8-4-2-1-3-7(8)9;/h1-6H,11H2,(H,12,13,14);1H2
InChIKey PQJWXZDNTYSZKW-UHFFFAOYSA-N
Molecular Weight 241.27
Solvent Dimethyl sulfoxide-d6; Reference=TMS Spectrometer= Bruker AC-300
Synonyms 1-NAPHTHALENESULFONIC ACID, 4-AMINO-, HYDRATE