Vitas-M small molecule compound
6,6-dimethyl-5,7-dinitro-2-phenyl-1,3-diazatricyclo[3.3.1.1~3,7~]decane
Catalog ID
STK867838
SMILES CC1(C)C2(CN3CC1(CN(C2)C3c1ccccc1)[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 C16H20N4O4 MW 332.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N4O4/c1-14(2)15(19(21)22)8-17-10-16(14,20(23)24)11-18(9-15)13(17)12-6-4-3-5-7-12/h3-7,13H,8-11H2,1-2H3InChIKey
CQCUASFADUSHQL-UHFFFAOYSA-NSynonyms
371782-06-8(1R3S5s7s)66dimethyl57dinitro2phenyl13diazaadamantane
13DIAZAADAMANTANE66DIMETHYL57DINITRO2PHENYL
371782068
66dimethyl57dinitro2phenyl13diazatricyclo(3311~37~)decane
CC1(C)C2(CN3CC1(CN(C2)C3c1ccccc1)(N+)(=O)(O))(N+)(=O)(O)
CC1(C2(CN3CC1(CN(C2)C3C4=CC=CC=C4)(N+)(=O)(O))(N+)(=O)(O))C
InChI=1SC16H20N4O4c114(2)15(19(21)22)8171016(1420(23)24)1118(915)13(17)126435712h3713H811H212H3
MFCD01558796
ZINC000019320413
ZINC19320413
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