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N-METHOXY-4-AZA-5-ALPHA-CHOLESTAN-3-ONE
SpectraBase Compound ID 9eHLe5ZcJiP
InChI InChI=1S/C27H47NO2/c1-18(2)8-7-9-19(3)21-11-12-22-20-10-13-24-27(5,17-15-25(29)28(24)30-6)23(20)14-16-26(21,22)4/h18-24H,7-17H2,1-6H3/t19-,20+,21-,22+,23+,24-,26-,27-/m1/s1
InChIKey KZTJBGUOHIDMSA-GRFPRMRASA-N
Mol Weight 417.7 g/mol
Molecular Formula C27H47NO2
Exact Mass 417.36068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1Pi8wVxDcaL
Name N-METHOXY-4-AZA-5-ALPHA-CHOLESTAN-3-ONE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H47NO2
InChI InChI=1S/C27H47NO2/c1-18(2)8-7-9-19(3)21-11-12-22-20-10-13-24-27(5,17-15-25(29)28(24)30-6)23(20)14-16-26(21,22)4/h18-24H,7-17H2,1-6H3/t19-,20+,21-,22+,23+,24-,26-,27-/m1/s1
InChIKey KZTJBGUOHIDMSA-GRFPRMRASA-N
Literature Reference Author O.E.EDWARDS,G.GRUE-SORENSEN,B.A.BLACKWELL
Literature Reference Citation CAN.J.CHEM.,75,857(1997)
Literature Reference DOI 10.1139/v97-104
Molecular Weight 417.676 g/mol
Solvent CDCl3
Source File Reference UWCP6479