beta-alanine, N-[(2E)-2-(benzoylamino)-3-(2-furanyl)-1-oxo-2-propenyl]-, phenylmethyl ester

SpectraBase Compound ID	8PLpIyU71sn
InChI	InChI=1S/C24H22N2O5/c27-22(31-17-18-8-3-1-4-9-18)13-14-25-24(29)21(16-20-12-7-15-30-20)26-23(28)19-10-5-2-6-11-19/h1-12,15-16H,13-14,17H2,(H,25,29)(H,26,28)/b21-16+
InChIKey	PNMAOBHGLKCMPW-LTGZKZEYSA-N Google Search
Mol Weight	418.45 g/mol
Molecular Formula	C24H22N2O5
Exact Mass	418.152872 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	AH4vV9AeNek
Name	beta-alanine, N-[(2E)-2-(benzoylamino)-3-(2-furanyl)-1-oxo-2-propenyl]-, phenylmethyl ester
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C24H22N2O5/c27-22(31-17-18-8-3-1-4-9-18)13-14-25-24(29)21(16-20-12-7-15-30-20)26-23(28)19-10-5-2-6-11-19/h1-12,15-16H,13-14,17H2,(H,25,29)(H,26,28)/b21-16+
InChIKey	PNMAOBHGLKCMPW-LTGZKZEYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_8313_7450
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: NMR/10329072