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

*Links on SpectraBase are not permalinks.
acetamido(3-bromo-4-fluorobenzyl)malonic acid, diethyl ester
SpectraBase Compound ID BxI6pbKYDPz
InChI InChI=1S/C16H19BrFNO5/c1-4-23-14(21)16(19-10(3)20,15(22)24-5-2)9-11-6-7-13(18)12(17)8-11/h6-8H,4-5,9H2,1-3H3,(H,19,20)
InChIKey BHTYMOXEQVTOED-UHFFFAOYSA-N
Mol Weight 404.23 g/mol
Molecular Formula C16H19BrFNO5
Exact Mass 403.043064 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H 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 HrEa193j9UY
Name acetamido(3-bromo-4-fluorobenzyl)malonic acid, diethyl ester
Source of Sample J. I. Degraw & M. Cory, Stanford Research Institute, Menlo Park, California
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19BrFNO5
InChI InChI=1S/C16H19BrFNO5/c1-4-23-14(21)16(19-10(3)20,15(22)24-5-2)9-11-6-7-13(18)12(17)8-11/h6-8H,4-5,9H2,1-3H3,(H,19,20)
InChIKey BHTYMOXEQVTOED-UHFFFAOYSA-N
Instrument Name Varian A-60
Literature Reference JMCH 10, 64(1967)
Sadtler NMR Number 5516M
Solvent CDCl3
Synonyms MALONIC ACID, ACETAMIDO/3-BROMO-4- FLUOROBENZYL/-, DIETHYL ESTER