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6-hydroxyspiro[chroman-2,1'-cyclohexan]-4-one, benzenesulfonate
SpectraBase Compound ID DBZiCPHFkol
InChI InChI=1S/C20H20O5S/c21-18-14-20(11-5-2-6-12-20)24-19-10-9-15(13-17(18)19)25-26(22,23)16-7-3-1-4-8-16/h1,3-4,7-10,13H,2,5-6,11-12,14H2
InChIKey JGZHPJNFDYQPTH-UHFFFAOYSA-N
Mol Weight 372.44 g/mol
Molecular Formula C20H20O5S
Exact Mass 372.103145 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 240wi1wDJdY
Name 6-HYDROXYSPIRO[CHROMAN-2,1'-CYCLOHEXAN]-4-ONE, BENZENESULFONATE
Source of Sample A. Cascaval, "Al. I. CUZA" University of Iassy, Iasi, Romania
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20O5S
InChI InChI=1S/C20H20O5S/c21-18-14-20(11-5-2-6-12-20)24-19-10-9-15(13-17(18)19)25-26(22,23)16-7-3-1-4-8-16/h1,3-4,7-10,13H,2,5-6,11-12,14H2
InChIKey JGZHPJNFDYQPTH-UHFFFAOYSA-N
Melting Point 86-87C
Molecular Weight 372.44
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms SPIRO/CHROMAN-2,1'-CYCLOHEXAN/- 4-ONE, 6-HYDROXY-, BENZENESULFONATE