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benzenepropanoic acid, 4-methyl-beta-[[1-oxo-3-(2,5,7-trimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propyl]amino]-, ethyl ester

View entire compound with spectra: 1 NMR

benzenepropanoic acid, 4-methyl-beta-[[1-oxo-3-(2,5,7-trimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propyl]amino]-, ethyl ester
SpectraBase Compound ID I8Y2SDuW85j
InChI InChI=1S/C23H29N5O3/c1-6-31-22(30)13-20(18-9-7-14(2)8-10-18)26-21(29)12-11-19-15(3)24-23-25-17(5)27-28(23)16(19)4/h7-10,20H,6,11-13H2,1-5H3,(H,26,29)
InChIKey WCHHKDGOFWXRTN-UHFFFAOYSA-N
Mol Weight 423.52 g/mol
Molecular Formula C23H29N5O3
Exact Mass 423.22704 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CTxPkE5KHdP
Name benzenepropanoic acid, 4-methyl-beta-[[1-oxo-3-(2,5,7-trimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propyl]amino]-, ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 423.227039811 u
Formula C23H29N5O3
InChI InChI=1S/C23H29N5O3/c1-6-31-22(30)13-20(18-9-7-14(2)8-10-18)26-21(29)12-11-19-15(3)24-23-25-17(5)27-28(23)16(19)4/h7-10,20H,6,11-13H2,1-5H3,(H,26,29)
InChIKey WCHHKDGOFWXRTN-UHFFFAOYSA-N
Molecular Weight 423.517 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_5858
Solvent DMSO-d6
Source Vendor ID: NMR/12709245