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

*Links on SpectraBase are not permalinks.
1-(4-Fluorobenzyl)-4-(6,7-dimethoxy-2-oxo-2H-chromen-3-ylcarbamoyl)pyridinium bromide
SpectraBase Compound ID 1aVQCP3sYCL
InChI InChI=1S/C24H19FN2O5.BrH/c1-30-21-12-17-11-19(24(29)32-20(17)13-22(21)31-2)26-23(28)16-7-9-27(10-8-16)14-15-3-5-18(25)6-4-15;/h3-13H,14H2,1-2H3;1H
InChIKey BZWCTPXKQACQPM-UHFFFAOYSA-N
Mol Weight 515.34 g/mol
Molecular Formula C24H20BrFN2O5
Exact Mass 514.053963 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 GWNDiUIgs3z
Name 1-(4-Fluorobenzyl)-4-(6,7-dimethoxy-2-oxo-2H-chromen-3-ylcarbamoyl)pyridinium bromide
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H20BrFN2O5
InChI InChI=1S/C24H19FN2O5.BrH/c1-30-21-12-17-11-19(24(29)32-20(17)13-22(21)31-2)26-23(28)16-7-9-27(10-8-16)14-15-3-5-18(25)6-4-15;/h3-13H,14H2,1-2H3;1H
InChIKey BZWCTPXKQACQPM-UHFFFAOYSA-N
Instrument Name Finnigan POLARIS
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.14.231
Molecular Weight 515.335 g/mol
Reported Formula C24H20BrFN2O5
SMILES [Br-].N(C=1C(Oc2c(cc(c(c2)OC)OC)C1)=O)C(c1cc[n+](cc1)Cc1ccc(cc1)F)=O
SPLASH splash10-0a4i-1902000000-f089b584898af2bce45a
Source of Spectrum BJO-14-SM12-9g
Wiley ID 1845741