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4-(6-bromo-1,3-benzodioxol-5-yl)-1-cyclopropyl-4H-pyridine-3,5-dicarboxylic acid dimethyl ester
SpectraBase Compound ID KTr8XsBQpkD
InChI InChI=1S/C19H18BrNO6/c1-24-18(22)12-7-21(10-3-4-10)8-13(19(23)25-2)17(12)11-5-15-16(6-14(11)20)27-9-26-15/h5-8,10,17H,3-4,9H2,1-2H3
InChIKey VOGAIFXIIKKEKH-UHFFFAOYSA-N
Mol Weight 436.26 g/mol
Molecular Formula C19H18BrNO6
Exact Mass 435.03175 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IyokVJxED7w
Name 4-(6-bromo-1,3-benzodioxol-5-yl)-1-cyclopropyl-4H-pyridine-3,5-dicarboxylic acid dimethyl ester
Alternate Name(s) Dimethyl 4-(6-bromanyl-1,3-benzodioxol-5-yl)-1-cyclopropyl-4H-pyridine-3,5-dicarboxylate Dimethyl 4-(6-bromo-1,3-benzodioxol-5-yl)-1-cyclopropyl-4H-pyridine-3,5-dicarboxylate
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Formula C19H18BrNO6
InChI InChI=1S/C19H18BrNO6/c1-24-18(22)12-7-21(10-3-4-10)8-13(19(23)25-2)17(12)11-5-15-16(6-14(11)20)27-9-26-15/h5-8,10,17H,3-4,9H2,1-2H3
InChIKey VOGAIFXIIKKEKH-UHFFFAOYSA-N
Molecular Weight 436.258 g/mol
SMILES C=1(C(C(C(=O)OC)=CN(C1)C1CC1)c1c(cc2c(c1)OCO2)Br)C(=O)OC
SPLASH splash10-000i-1390000000-2b8ddbcbe212c8b43f77
Wiley ID 1461827