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N,N-DIBUTYL-3-HYDROXY-4-(5-HYDROXY-3-METHYL-1-PHENYL-1H-PYRAZOL-4-YL-AZO)-1-NAPHTHALENESULFONAMIDE
SpectraBase Compound ID 3cYVCgVE29K
InChI InChI=1S/C28H33N5O4S/c1-4-6-17-32(18-7-5-2)38(36,37)25-19-24(34)27(23-16-12-11-15-22(23)25)30-29-26-20(3)31-33(28(26)35)21-13-9-8-10-14-21/h8-16,19,34-35H,4-7,17-18H2,1-3H3/b30-29+
InChIKey ZGCQCUAHURBDJO-QVIHXGFCSA-N
Mol Weight 535.7 g/mol
Molecular Formula C28H33N5O4S
Exact Mass 535.225326 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7s9Hj0g7lX5
Name N,N-DIBUTYL-3-HYDROXY-4-(5-HYDROXY-3-METHYL-1-PHENYL-1H-PYRAZOL-4-YL-AZO)-1-NAPHTHALENESULFONAMIDE
Compound Number 7A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H33N5O4S
InChI InChI=1S/C28H33N5O4S/c1-4-6-17-32(18-7-5-2)38(36,37)25-19-24(34)27(23-16-12-11-15-22(23)25)30-29-26-20(3)31-33(28(26)35)21-13-9-8-10-14-21/h8-16,19,34-35H,4-7,17-18H2,1-3H3/b30-29+
InChIKey ZGCQCUAHURBDJO-QVIHXGFCSA-N
Literature Reference Author A.R.KATRITZKY,B.RACHWAL,S.RACHWAL,T.P.SMITH,D.W.MACOMBER
Literature Reference Citation REC.TR.CH.P.-B.,112,552(1993)
Literature Reference DOI 10.1002/recl.19931121007
Molecular Weight 535.661 g/mol
Solvent CDCl3
Source File Reference UWTS2176