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7-(1-Oxo-1H-2-benzopyran-3-yl)naphthalene-1-sulfonic acid Dihydrate
SpectraBase Compound ID Gw7QI9EsLYJ
InChI InChI=1S/C19H12O5S.2H2O/c20-19-15-6-2-1-4-13(15)11-17(24-19)14-9-8-12-5-3-7-18(16(12)10-14)25(21,22)23;;/h1-11H,(H,21,22,23);2*1H2
InChIKey TXSUCMBOAUQBFF-UHFFFAOYSA-N
Mol Weight 388.39 g/mol
Molecular Formula C19H16O7S
Exact Mass 388.061674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I4YMXdCmDSD
Name 7-(1-Oxo-1H-2-benzopyran-3-yl)naphthalene-1-sulfonic acid Dihydrate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16O7S
InChI InChI=1S/C19H12O5S.2H2O/c20-19-15-6-2-1-4-13(15)11-17(24-19)14-9-8-12-5-3-7-18(16(12)10-14)25(21,22)23;;/h1-11H,(H,21,22,23);2*1H2
InChIKey TXSUCMBOAUQBFF-UHFFFAOYSA-N
Molecular Weight 388.390 g/mol
SMILES O.OS(c1cccc2ccc(cc12)C1=Cc2c(C(O1)=O)cccc2)(=O)=O.O
SPLASH splash10-0fk9-0097000000-762af0ecd433c6c899a0
Source of Spectrum F4-0-2703-4
Synonyms 7-(1-oxo-1H-isochromen-3-yl)naphthalene-1-sulfonic acid dihydrate
Wiley ID 1620374