For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Pyridine-3,5-dicarboxylic acid, 1,4-dihydro-4-(5-bromo-2-methoxyphenyl)-, dimethyl ester
SpectraBase Compound ID BkXY4ES2b8g
InChI InChI=1S/C16H16BrNO5/c1-21-13-5-4-9(17)6-10(13)14-11(15(19)22-2)7-18-8-12(14)16(20)23-3/h4-8,14,18H,1-3H3
InChIKey ZXWBCNVDSFUMDK-UHFFFAOYSA-N
Mol Weight 382.21 g/mol
Molecular Formula C16H16BrNO5
Exact Mass 381.021186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2gfJxamHqZK
Name Pyridine-3,5-dicarboxylic acid, 1,4-dihydro-4-(5-bromo-2-methoxyphenyl)-, dimethyl ester
Alternate Name(s) 4-(5-bromo-2-methoxy-phenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester Dimethyl 4-(5-bromanyl-2-methoxy-phenyl)-1,4-dihydropyridine-3,5-dicarboxylate Dimethyl 4-(5-bromo-2-methoxy-phenyl)-1,4-dihydropyridine-3,5-dicarboxylate 4-(5-bromo-2-methoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester
CAS Registry Number 11-74-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16BrNO5
InChI InChI=1S/C16H16BrNO5/c1-21-13-5-4-9(17)6-10(13)14-11(15(19)22-2)7-18-8-12(14)16(20)23-3/h4-8,14,18H,1-3H3
InChIKey ZXWBCNVDSFUMDK-UHFFFAOYSA-N
Molecular Weight 382.210 g/mol
SMILES N1C=C(C(C(=C1)C(=O)OC)c1c(ccc(c1)Br)OC)C(=O)OC
SPLASH splash10-00kb-1927000000-3341a105d54aea97be98
Wiley ID 1461324