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1-cyclopropyl-4-(2,3,4-trimethoxyphenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester
SpectraBase Compound ID GBvWhSdxYCn
InChI InChI=1S/C21H25NO7/c1-25-16-9-8-13(18(26-2)19(16)27-3)17-14(20(23)28-4)10-22(12-6-7-12)11-15(17)21(24)29-5/h8-12,17H,6-7H2,1-5H3
InChIKey SMMXICDDBRNJKK-UHFFFAOYSA-N
Mol Weight 403.43 g/mol
Molecular Formula C21H25NO7
Exact Mass 403.163102 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5cSDfI7U4qx
Name 1-cyclopropyl-4-(2,3,4-trimethoxyphenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25NO7
InChI InChI=1S/C21H25NO7/c1-25-16-9-8-13(18(26-2)19(16)27-3)17-14(20(23)28-4)10-22(12-6-7-12)11-15(17)21(24)29-5/h8-12,17H,6-7H2,1-5H3
InChIKey SMMXICDDBRNJKK-UHFFFAOYSA-N
Molecular Weight 403.431 g/mol
SMILES C=1(C(C(C(=O)OC)=CN(C1)C1CC1)c1c(c(OC)c(cc1)OC)OC)C(=O)OC
SPLASH splash10-000f-9422000000-2d6bb29cc2d94c557f44
Synonyms Dimethyl 1-cyclopropyl-4-(2,3,4-trimethoxyphenyl)-4H-pyridine-3,5-dicarboxylate
Wiley ID 1464670