Vitas-M small molecule compound
9-(1,3-benzodioxol-5-yl)-7,7-dimethyl-8-nitro-1,4-dioxaspiro[4.5]decane
Catalog ID
STK684573
SMILES [O-][N+](=O)C1C(CC2(CC1(C)C)OCCO2)c1ccc2c(c1)OCO2
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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 C17H21NO6 MW 335.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21NO6/c1-16(2)9-17(23-5-6-24-17)8-12(15(16)18(19)20)11-3-4-13-14(7-11)22-10-21-13/h3-4,7,12,15H,5-6,8-10H2,1-2H3InChIKey
HSWNWAPEMBLGIW-UHFFFAOYSA-NSynonyms
(8R9R)9(13BENZODIOXOL5YL)77DIMETHYL8NITRO14DIOXASPIRO(45)DECANE
(O)(N+)(=O)C1C(CC2(CC1(C)C)OCCO2)c1ccc2c(c1)OCO2
7(13BENZODIOXOL5YL)99DIMETHYL8NITRO14DIOXASPIRO(45)DECANE
9(13benzodioxol5yl)77dimethyl8nitro14dioxaspiro(45)decane
CC1(CC2(CC(C1(N+)(=O)(O))C3=CC4=C(C=C3)OCO4)OCCO2)C
InChI=1SC17H21NO6c116(2)917(23562417)812(15(16)18(19)20)11341314(711)22102113h3471215H56810H212H3
MFCD05855009
ZINC000001425869
ZINC000001425872
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