| SpectraBase Compound ID | Lr5GvoKPxA0 |
|---|---|
| InChI | InChI=1S/C16H27Br2N4O7P/c1-27-16(23)14(19)4-2-3-9-20-30(26,21(10-7-17)11-8-18)28-12-13-5-6-15(29-13)22(24)25/h5-6,14H,2-4,7-12,19H2,1H3,(H,20,26) |
| InChIKey | AKGDIWVRXAPUMM-UHFFFAOYSA-N |
| Mol Weight | 578.19 g/mol |
| Molecular Formula | C16H27Br2N4O7P |
| Exact Mass | 575.998412 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1DOVZZfOvCX |
|---|---|
| Name | (5-NITRO-2-FURYL)-METHYL-N(EPSILON)-(O-METHYLLYSYL)-N,N-BIS-(2-BROMOETHYL)-PHOSPHORODIAMIDATE |
| Compound Number | 3A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C16H27Br2N4O7P |
| InChI | InChI=1S/C16H27Br2N4O7P/c1-27-16(23)14(19)4-2-3-9-20-30(26,21(10-7-17)11-8-18)28-12-13-5-6-15(29-13)22(24)25/h5-6,14H,2-4,7-12,19H2,1H3,(H,20,26) |
| InChIKey | AKGDIWVRXAPUMM-UHFFFAOYSA-N |
| Literature Reference Author | G.STEINBERG,R.F.BORCH |
| Literature Reference Citation | J.MED.CHEM.,44,69(2001) |
| Literature Reference DOI | 10.1021/jm000306g |
| Solvent | CDCl3 |
| Source File Reference | UWSI43920 |