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2-naphthalenesulfonic acid, monohydrate

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2-naphthalenesulfonic acid, monohydrate
SpectraBase Compound ID LCWIGqE3zBP
InChI InChI=1S/C10H8O3S.H2O/c11-14(12,13)10-6-5-8-3-1-2-4-9(8)7-10;/h1-7H,(H,11,12,13);1H2
InChIKey HKGOFWIZZIYCOS-UHFFFAOYSA-N
Mol Weight 226.246 g/mol
Molecular Formula C10H10O4S
Exact Mass 226.02998 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6pePsAQlwpE
Name 2-NAPHTHALENESULFONIC ACID, MONOHYDRATE
Source of Sample Eastman Organic Chemicals, Rochester, New York
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H8O3S H2O
InChI InChI=1S/C10H8O3S.H2O/c11-14(12,13)10-6-5-8-3-1-2-4-9(8)7-10;/h1-7H,(H,11,12,13);1H2
InChIKey HKGOFWIZZIYCOS-UHFFFAOYSA-N
Melting Point 120-122C
Molecular Weight 226.25
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms 2-NAPHTHALENESULFONIC ACID, MONOHYDRATE