| SpectraBase Spectrum ID |
LfZC3DcaGxR |
| Name |
[1-(1-adamantyl)-4-nitro-3-pyrazolyl]-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone |
| Alternate Name(s) |
[1-(1-adamantyl)-4-nitro-pyrazol-3-yl]-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H29N5O3 |
| InChI |
InChI=1S/C21H29N5O3/c27-20(24-5-4-23-3-1-2-17(23)12-24)19-18(26(28)29)13-25(22-19)21-9-14-6-15(10-21)8-16(7-14)11-21/h13-17H,1-12H2/t14-,15+,16-,17?,21- |
| InChIKey |
LMNQGTIZZKCHRA-LWYJVMDTSA-N |
| Molecular Weight |
399.495 g/mol |
| SMILES |
C1[C@]2(C[C@]3(C[C@@]1(CC(C3)(C2)[n]1nc(c(c1)N(=O)=O)C(=O)N1CC2N(CC1)CCC2)[H])[H])[H] |
| SPLASH |
splash10-000i-6913000000-c9904de616cfa43d5506 |
| Wiley ID |
1442423 |
![[1-(1-adamantyl)-4-nitro-3-pyrazolyl]-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone](/api/spectrum/LfZC3DcaGxR/structure.png?h=300&w=458 "[1-(1-adamantyl)-4-nitro-3-pyrazolyl]-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone")
