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

*Links on SpectraBase are not permalinks.
Propionic acid, 3-[(benzo[1,3]dioxol-5-ylmethyl)amino]-3-(2-chlorophenyl)-, ethyl ester
SpectraBase Compound ID JkAE8HVGSa1
InChI InChI=1S/C19H20ClNO4/c1-2-23-19(22)10-16(14-5-3-4-6-15(14)20)21-11-13-7-8-17-18(9-13)25-12-24-17/h3-9,16,21H,2,10-12H2,1H3
InChIKey IPGLZCKRRGVLFN-UHFFFAOYSA-N
Mol Weight 361.83 g/mol
Molecular Formula C19H20ClNO4
Exact Mass 361.108086 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 6fUmgzjcL8c
Name Propionic acid, 3-[(benzo[1,3]dioxol-5-ylmethyl)amino]-3-(2-chlorophenyl)-, ethyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 361.108085824 u
Formula C19H20ClNO4
InChI InChI=1S/C19H20ClNO4/c1-2-23-19(22)10-16(14-5-3-4-6-15(14)20)21-11-13-7-8-17-18(9-13)25-12-24-17/h3-9,16,21H,2,10-12H2,1H3
InChIKey IPGLZCKRRGVLFN-UHFFFAOYSA-N
Molecular Weight 361.825 g/mol
SMILES C(C(C1=C(Cl)C=CC=C1)NCC=1C=C2OCOC2=CC1)C(=O)OCC