| SpectraBase Spectrum ID |
4JEUF6T8BzD |
| Name |
(4R)-N-Benzyl-N-(tert.-butyloxycarbonyl)-4-diphenylphosphatoxy-5-methyl-5-nitrohexylamine |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
598.244403214 u |
| Formula |
C31H39N2O8P |
| InChI |
InChI=1S/C31H39N2O8P/c1-30(2,3)38-29(34)32(24-25-16-9-6-10-17-25)23-15-22-28(31(4,5)33(35)36)41-42(37,39-26-18-11-7-12-19-26)40-27-20-13-8-14-21-27/h6-14,16-21,28H,15,22-24H2,1-5H3/t28-/m1/s1 |
| InChIKey |
PXBFNUGJBFLXHR-MUUNZHRXSA-N |
| Molecular Weight |
598.633 g/mol |
| SMILES |
C(N(=O)=O)(C)(C)[C@@](CCCN(CC1=CC=CC=C1)C(=O)OC(C)(C)C)(OP(=O)(OC1=CC=CC=C1)OC1=CC=CC=C1)[H] |
