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benzenepropanoic acid, 4-(1-methylethoxy)-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 2AhBdcfYRcM
InChI InChI=1S/C25H33N5O4/c1-7-33-24(32)14-22(19-8-10-20(11-9-19)34-15(2)3)28-23(31)13-12-21-16(4)26-25-27-18(6)29-30(25)17(21)5/h8-11,15,22H,7,12-14H2,1-6H3,(H,28,31)
InChIKey RZCFCHXZAITMBD-UHFFFAOYSA-N
Mol Weight 467.6 g/mol
Molecular Formula C25H33N5O4
Exact Mass 467.253255 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8xDBcmFjRhM
Name benzenepropanoic acid, 4-(1-methylethoxy)-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 467.253254559 u
Formula C25H33N5O4
InChI InChI=1S/C25H33N5O4/c1-7-33-24(32)14-22(19-8-10-20(11-9-19)34-15(2)3)28-23(31)13-12-21-16(4)26-25-27-18(6)29-30(25)17(21)5/h8-11,15,22H,7,12-14H2,1-6H3,(H,28,31)
InChIKey RZCFCHXZAITMBD-UHFFFAOYSA-N
Molecular Weight 467.570 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_5859
Solvent DMSO-d6
Source Vendor ID: NMR/12709246