valine, N-[(1,3-dihydro-1-oxo-2H-isoindol-2-yl)phenylacetyl]-,methyl ester

SpectraBase Compound ID	D5byehBfdTJ
InChI	InChI=1S/C22H24N2O4/c1-14(2)18(22(27)28-3)23-20(25)19(15-9-5-4-6-10-15)24-13-16-11-7-8-12-17(16)21(24)26/h4-12,14,18-19H,13H2,1-3H3,(H,23,25)
InChIKey	XRFNBEQMYUCJHU-UHFFFAOYSA-N Google Search
Mol Weight	380.44 g/mol
Molecular Formula	C22H24N2O4
Exact Mass	380.173607 g/mol

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SpectraBase Spectrum ID	GGBE835BBAG
Name	valine, N-[(1,3-dihydro-1-oxo-2H-isoindol-2-yl)phenylacetyl]-,methyl ester
Copyright	Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	380.173607257 u
Formula	C22H24N2O4
InChI	InChI=1S/C22H24N2O4/c1-14(2)18(22(27)28-3)23-20(25)19(15-9-5-4-6-10-15)24-13-16-11-7-8-12-17(16)21(24)26/h4-12,14,18-19H,13H2,1-3H3,(H,23,25)
InChIKey	XRFNBEQMYUCJHU-UHFFFAOYSA-N
Molecular Weight	380.444 g/mol
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2021_160
Solvent	DMSO-d6
Source	Vendor ID: NMR/12669654