| SpectraBase Spectrum ID |
D8hsU1WVfx8 |
| Name |
(1'R*,2'S*,3aS*,7S*,7aS*)-5-Ethoxy-6-morpholino-3a-nitroo-7-(2-nitrocyclopentyl)-2,3,3a,4,7,7a-hexahydro-1H-indene |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H31N3O6 |
| InChI |
InChI=1S/C20H31N3O6/c1-2-29-17-13-20(23(26)27)8-4-6-15(20)18(14-5-3-7-16(14)22(24)25)19(17)21-9-11-28-12-10-21/h14-16,18H,2-13H2,1H3/t14?,15-,16+,18+,20-/m0/s1 |
| InChIKey |
UYNCUNGOABNJBZ-BLARSJIKSA-N |
| Molecular Weight |
409.483 g/mol |
| SMILES |
[C@]12(N(=O)=O)[C@]([C@@](C3[C@](N(=O)=O)(CCC3)[H])(C(=C(C1)OCC)N1CCOCC1)[H])(CCC2)[H] |
| SPLASH |
splash10-017i-6359000000-fab6ca6d0ea0a24a4960 |
| Source of Spectrum |
KC-0-226-14 |
| Synonyms |
(1'R*,2'S*,3aS*,7S*,7aS*)-5-Ethoxy-6-morpholino-3a-nitro-7-(2-nitrocyclopentyl)-2,3,3a,4,7,7a-hexahydro-1H-indene |
| Wiley ID |
787097 |
