SpectraBase Compound ID | J8MHoBzmcWw |
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InChI | InChI=1S/C27H43NO2/c1-16-7-12-27(28-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(29)8-10-25(18,3)21(20)9-11-26(22,24)4/h5,16-17,19-24,28-29H,6-15H2,1-4H3/t16-,17?,19?,20?,21?,22?,23?,24?,25?,26?,27-/m1/s1 |
InChIKey | KWVISVAMQJWJSZ-AYGCYQGWSA-N |
Mol Weight | 413.6 g/mol |
Molecular Formula | C27H43NO2 |
Exact Mass | 413.32938 g/mol |
SpectraBase Spectrum ID | 7sViIHxSEVE |
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Name | Solasodine |
CAS Registry Number | 126-17-0 |
Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C27H43NO2 |
InChI | InChI=1S/C27H43NO2/c1-16-7-12-27(28-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(29)8-10-25(18,3)21(20)9-11-26(22,24)4/h5,16-17,19-24,28-29H,6-15H2,1-4H3/t16-,17?,19?,20?,21?,22?,23?,24?,25?,26?,27-/m1/s1 |
InChIKey | KWVISVAMQJWJSZ-AYGCYQGWSA-N |
Instrument Name | Jeol GX-270 |
Literature Reference | A.V. Patel, G. Blunden, T.A.Crabb, Magn. Res. Chem. 29, 794 (1991). |
NMR Standard | TMS |
Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
Solvent | CDCl3 |