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2-Pyridinecarboxylic acid, 6-(chloromethyl)-4-[3,4-dimethoxy-2-(phenylmethoxy)phenyl]-3-methyl-, methyl ester
SpectraBase Compound ID JERScrJVzpq
InChI InChI=1S/C24H24ClNO5/c1-15-19(12-17(13-25)26-21(15)24(27)30-4)18-10-11-20(28-2)23(29-3)22(18)31-14-16-8-6-5-7-9-16/h5-12H,13-14H2,1-4H3
InChIKey SSKWXOGLWABAGK-UHFFFAOYSA-N
Mol Weight 441.91 g/mol
Molecular Formula C24H24ClNO5
Exact Mass 441.134301 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BRPkmjPiECp
Name 2-Pyridinecarboxylic acid, 6-(chloromethyl)-4-[3,4-dimethoxy-2-(phenylmethoxy)phenyl]-3-methyl-, methyl ester
Alternate Name(s) methyl 4-[2-(benzyloxy)-3,4-dimethoxyphenyl]-6-(chloromethyl)-3-methyl-2-pyridinecarboxylate Methyl 6-(chloromethyl)-4-(3,4-dimethoxy-2-(phenylmethoxy)-phenyl)-3-methyl-2-pyridinecarboxylate
CAS Registry Number 74614-99-6
Comments Less than 3 mono-isotopic peaks
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Formula C24H24ClNO5
InChI InChI=1S/C24H24ClNO5/c1-15-19(12-17(13-25)26-21(15)24(27)30-4)18-10-11-20(28-2)23(29-3)22(18)31-14-16-8-6-5-7-9-16/h5-12H,13-14H2,1-4H3
InChIKey SSKWXOGLWABAGK-UHFFFAOYSA-N
Molecular Weight 441.911 g/mol
SMILES c1(-c2c(c(OC)c(cc2)OC)OCc2ccccc2)c(c(C(=O)OC)nc(c1)CCl)C
SPLASH splash10-0006-0000900000-fc8a4008165901d632e1
Source of Spectrum C-104-541-0
Wiley ID 1385061