| SpectraBase Compound ID | 9ifIbtA9vKJ |
|---|---|
| InChI | InChI=1S/C31H56N2/c1-27-15-11-7-6-9-13-17-29-25-32-20-14-10-5-3-2-4-8-12-16-28-23-30(31(29)19-22-32)26-33(24-28)21-18-27/h4,8,27-31H,2-3,5-7,9-26H2,1H3/b8-4-/t27-,28-,29+,30+,31-/m0/s1 |
| InChIKey | ASUYCOBPLIZBDP-OBDYYNBNSA-N |
| Mol Weight | 456.8 g/mol |
| Molecular Formula | C31H56N2 |
| Exact Mass | 456.44435 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4oq8DYJChUd |
|---|---|
| Name | XESTOPROXAMINE_C |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H56N2 |
| InChI | InChI=1S/C31H56N2/c1-27-15-11-7-6-9-13-17-29-25-32-20-14-10-5-3-2-4-8-12-16-28-23-30(31(29)19-22-32)26-33(24-28)21-18-27/h4,8,27-31H,2-3,5-7,9-26H2,1H3/b8-4-/t27-,28-,29+,30+,31-/m0/s1 |
| InChIKey | ASUYCOBPLIZBDP-OBDYYNBNSA-N |
| Literature Reference Author | B.I.MORINAKA,T.F.MOLINSKI |
| Literature Reference Citation | J.NAT.PROD.,74,430(2011) |
| Literature Reference DOI | 10.1021/np1008637 |
| Molecular Weight | 456.799 g/mol |
| Sample ID | 37417 |
| Solvent | CDCl3 |