Vitas-M small molecule compound
6,6-dimethyl-5,7-dinitro-2-propyl-1,3-diazatricyclo[3.3.1.1~3,7~]decane
Catalog ID
STK603230
SMILES CCCC1N2CC3(CN1CC(C2)(C3(C)C)[N+](=O)[O-])[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 C13H22N4O4 MW 298.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H22N4O4/c1-4-5-10-14-6-12(16(18)19)7-15(10)9-13(8-14,17(20)21)11(12,2)3/h10H,4-9H2,1-3H3InChIKey
MQWFHTXUIIRKSI-UHFFFAOYSA-NSynonyms
489404-94-6(1R3S5s7s)66dimethyl57dinitro2propyl13diazaadamantane
489404946
66dimethyl57dinitro2propyl13diazatricyclo(3311~37~)decane
CCCC1N2CC3(CN1CC(C2)(C3(C)C)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC13H22N4O4c1451014612(16(18)19)715(10)913(81417(20)21)11(122)3h10H49H213H3
MFCD03296174
ZINC000019320409
ZINC19320409
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