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KXOPYPPXFWYKDN-GQCTYLIASA-N

View entire compound with spectra: 1 NMR

KXOPYPPXFWYKDN-GQCTYLIASA-N
SpectraBase Compound ID H2ghxF3M8Xq
InChI InChI=1S/C31H44N2O2S/c1-23(5-4-6-25-11-15-34-17-25)27-9-13-30(20-32(27)3)19-31(36-22-30)14-10-28-24(2)7-8-29(33(28)21-31)26-12-16-35-18-26/h4,6,11-12,15-18,23-24,27-29H,5,7-10,13-14,19-22H2,1-3H3/b6-4+
InChIKey KXOPYPPXFWYKDN-GQCTYLIASA-N
Mol Weight 508.8 g/mol
Molecular Formula C31H44N2O2S
Exact Mass 508.31235 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3nG3FRtkE5B
Name KXOPYPPXFWYKDN-GQCTYLIASA-N
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H44N2O2S
InChI InChI=1S/C31H44N2O2S/c1-23(5-4-6-25-11-15-34-17-25)27-9-13-30(20-32(27)3)19-31(36-22-30)14-10-28-24(2)7-8-29(33(28)21-31)26-12-16-35-18-26/h4,6,11-12,15-18,23-24,27-29H,5,7-10,13-14,19-22H2,1-3H3/b6-4+
InChIKey KXOPYPPXFWYKDN-GQCTYLIASA-N
Literature Reference Author J.CYBULSKI,K.WOJTASIEWICZ
Literature Reference Citation J.MOL.STRUCT.,118,141(1984)
Literature Reference DOI 10.1016/0022-2860(84)85189-3
Molecular Weight 508.763 g/mol
Solvent CDCl3
Source File Reference UWCS9959