Vitas-M small molecule compound
6,6-dimethyl-5,7-dinitro-2-(5-nitrofuran-2-yl)-1,3-diazatricyclo[3.3.1.1~3,7~]decane
Catalog ID
STK543910
SMILES [O-][N+](=O)c1ccc(o1)C1N2CC3(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 C14H17N5O7 MW 367.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H17N5O7/c1-12(2)13(18(22)23)5-15-7-14(12,19(24)25)8-16(6-13)11(15)9-3-4-10(26-9)17(20)21/h3-4,11H,5-8H2,1-2H3InChIKey
KFCDJGNSVJAASB-UHFFFAOYSA-NSynonyms
488090-32-0(1R3S5s7s)66dimethyl57dinitro2(5nitrofuran2yl)13diazaadamantane
(O)(N+)(=O)c1ccc(o1)C1N2CC3(CN1CC(C2)(C3(C)C)(N+)(=O)(O))(N+)(=O)(O)
488090320
66dimethyl57dinitro2(5nitrofuran2yl)13diazatricyclo(3311~37~)decane
CC1(C2(CN3CC1(CN(C2)C3C4=CC=C(O4)(N+)(=O)(O))(N+)(=O)(O))(N+)(=O)(O))C
InChI=1SC14H17N5O7c112(2)13(18(22)23)515714(1219(24)25)816(613)11(15)93410(269)17(20)21h3411H58H212H3
MFCD03287989
ZINC000019319717
ZINC19319717
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