Vitas-M small molecule compound
3,3-dimethyl-1-(nitromethyl)-3,4-dihydroisoquinoline
Catalog ID
STK839635
SMILES [O-][N+](=O)CC1=NC(C)(C)Cc2c1cccc2
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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 C12H14N2O2 MW 218.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14N2O2/c1-12(2)7-9-5-3-4-6-10(9)11(13-12)8-14(15)16/h3-6H,7-8H2,1-2H3InChIKey
KVYNJWKWOAXONN-UHFFFAOYSA-NSynonyms
352448-55-6(O)(N+)(=O)CC1=NC(C)(C)Cc2c1cccc2
1(NITROMETHYL)33DIMETHYL34DIHYDROISOQUINOLINE
33dimethyl1(nitromethyl)34dihydroisoquinoline
33DIMETHYL1(NITROMETHYL)4HISOQUINOLINE
33DIMETHYL1NITROMETHYL34DIHYDROISOQUINOLINE
352448556
CC1(CC2=CC=CC=C2C(=N1)C(N+)(=O)(O))C
InChI=1SC12H14N2O2c112(2)79534610(9)11(1312)814(15)16h36H78H212H3
MFCD02130588
ZINC000000104139
ZINC00104139
ZINC104139
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