| SpectraBase Compound ID | 646SwN6hmw |
|---|---|
| InChI | InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18-,19+,20+,21-,22+,23-,24-,25+/m1/s1 |
| InChIKey | DBODJJZRZFZBBD-AFIQFUOFSA-N |
| Mol Weight | 451.6 g/mol |
| Molecular Formula | C25H41NO6 |
| Exact Mass | 451.293388 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CStLWrpia8T |
|---|---|
| Name | CHASMANINE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H41NO6 |
| InChI | InChI=1S/C25H41NO6/c1-6-26-11-23(12-29-2)8-7-16(31-4)25-14-9-13-15(30-3)10-24(28,17(14)19(13)27)18(22(25)26)20(32-5)21(23)25/h13-22,27-28H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18-,19+,20+,21-,22+,23-,24-,25+/m1/s1 |
| InChIKey | DBODJJZRZFZBBD-AFIQFUOFSA-N |
| Literature Reference Author | F.GAO,Y.Y.LI,D.WANG,X.HUANG,Q.LIU |
| Literature Reference Citation | MOLECULES,17,5187(2012) |
| Literature Reference DOI | 10.3390/molecules17055187 |
| Molecular Weight | 451.604 g/mol |
| Sample ID | 1096 |
| Solvent | CDCl3 |