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

*Links on SpectraBase are not permalinks.

Quinoline-4-carboxylic acid, 6-bromo-2-methyl-, 2-fluorobenzyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Quinoline-4-carboxylic acid, 6-bromo-2-methyl-, 2-fluorobenzyl ester
SpectraBase Compound ID 59kvXMNFAei
InChI InChI=1S/C18H13BrFNO2/c1-11-8-15(14-9-13(19)6-7-17(14)21-11)18(22)23-10-12-4-2-3-5-16(12)20/h2-9H,10H2,1H3
InChIKey BQUDHOMQTGVYKJ-UHFFFAOYSA-N
Mol Weight 374.21 g/mol
Molecular Formula C18H13BrFNO2
Exact Mass 373.01137 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID A8X41bxLMGI
Name Quinoline-4-carboxylic acid, 6-bromo-2-methyl-, 2-fluorobenzyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 373.011369824 u
Formula C18H13BrFNO2
InChI InChI=1S/C18H13BrFNO2/c1-11-8-15(14-9-13(19)6-7-17(14)21-11)18(22)23-10-12-4-2-3-5-16(12)20/h2-9H,10H2,1H3
InChIKey BQUDHOMQTGVYKJ-UHFFFAOYSA-N
Molecular Weight 374.209 g/mol
SMILES C12=CC=C(C=C2C(C(OCC2=CC=CC=C2F)=O)=CC(=N1)C)Br