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

*Links on SpectraBase are not permalinks.

Benzofuran-2-carboxylic acid, 5-bromo-3-(2-morpholin-4-yl-acetylamino)-, ethyl ester

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

Benzofuran-2-carboxylic acid, 5-bromo-3-(2-morpholin-4-yl-acetylamino)-, ethyl ester
SpectraBase Compound ID FcIG64ZCNeM
InChI InChI=1S/C17H19BrN2O5/c1-2-24-17(22)16-15(12-9-11(18)3-4-13(12)25-16)19-14(21)10-20-5-7-23-8-6-20/h3-4,9H,2,5-8,10H2,1H3,(H,19,21)
InChIKey OVBPPJFSLYZTFT-UHFFFAOYSA-N
Mol Weight 411.25 g/mol
Molecular Formula C17H19BrN2O5
Exact Mass 410.047735 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 4RiAVDjldiW
Name Benzofuran-2-carboxylic acid, 5-bromo-3-(2-morpholin-4-yl-acetylamino)-, ethyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 410.047734715 u
Formula C17H19BrN2O5
InChI InChI=1S/C17H19BrN2O5/c1-2-24-17(22)16-15(12-9-11(18)3-4-13(12)25-16)19-14(21)10-20-5-7-23-8-6-20/h3-4,9H,2,5-8,10H2,1H3,(H,19,21)
InChIKey OVBPPJFSLYZTFT-UHFFFAOYSA-N
Molecular Weight 411.252 g/mol
SMILES C1(=C(C2=CC(Br)=CC=C2O1)NC(CN1CCOCC1)=O)C(=O)OCC