Vitas-M small molecule compound
1,1'-(9,9-dimethyl-1,5-dinitro-3,7-diazabicyclo[3.3.1]nonane-3,7-diyl)diethanone
Catalog ID
STK831236
SMILES CC(=O)N1CC2(CN(CC(C1)(C2(C)C)[N+](=O)[O-])C(=O)C)[N+](=O)[O-]
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C13H20N4O6 MW 328.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H20N4O6/c1-9(18)14-5-12(16(20)21)7-15(10(2)19)8-13(6-14,17(22)23)11(12,3)4/h5-8H2,1-4H3InChIKey
NHNWMGAPTRPYJZ-UHFFFAOYSA-NSynonyms
90237-67-51(3ACETYL99DIMETHYL15DINITRO37DIAZABICYCLO(331)NONAN7YL)ETHANONE
1(7ACETYL99DIMETHYL15DINITRO37DIAZABICYCLO(331)NON3YL)ETHANONE
11((1s5s)99dimethyl15dinitro37diazabicyclo(331)nonane37diyl)diethanone
11(99dimethyl15dinitro37diazabicyclo(331)nonane37diyl)diethanone
37DIACETYL99DIMETHYL15DINITRO37DIAZABICYCLO(331)NONANE
37DIAZABICYCLO(331)NONANE37DIACETYL99DIMETHYL15DINITRO
90237675
CC(=O)N1CC2(CN(CC(C1)(C2(C)C)(N+)(=O)(O))C(=O)C)(N+)(=O)(O)
InChI=1SC13H20N4O6c19(18)14512(16(20)21)715(10(2)19)813(61417(22)23)11(123)4h58H214H3
MFCD01898097
ZINC000004311370
ZINC04311370
ZINC4311370
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