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benzenepropanoic acid, beta-[[3-[2-(4-chlorophenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-1-oxopropyl]amino]-4-(1-methylethoxy)-,

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benzenepropanoic acid, beta-[[3-[2-(4-chlorophenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-1-oxopropyl]amino]-4-(1-methylethoxy)-,
SpectraBase Compound ID 3VBmScp8URJ
InChI InChI=1S/C31H35ClN4O4/c1-6-39-31(38)18-27(22-9-13-25(14-10-22)40-19(2)3)34-30(37)16-15-26-20(4)33-29-17-28(35-36(29)21(26)5)23-7-11-24(32)12-8-23/h7-14,17,19,27H,6,15-16,18H2,1-5H3,(H,34,37)
InChIKey KSRKUNUCXMMCED-UHFFFAOYSA-N
Mol Weight 563.1 g/mol
Molecular Formula C31H35ClN4O4
Exact Mass 562.234683 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID H8GWT22X3ys
Name benzenepropanoic acid, beta-[[3-[2-(4-chlorophenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-1-oxopropyl]amino]-4-(1-methylethoxy)-,
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 562.234683319 u
Formula C31H35ClN4O4
InChI InChI=1S/C31H35ClN4O4/c1-6-39-31(38)18-27(22-9-13-25(14-10-22)40-19(2)3)34-30(37)16-15-26-20(4)33-29-17-28(35-36(29)21(26)5)23-7-11-24(32)12-8-23/h7-14,17,19,27H,6,15-16,18H2,1-5H3,(H,34,37)
InChIKey KSRKUNUCXMMCED-UHFFFAOYSA-N
Molecular Weight 563.098 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2842
Solvent DMSO-d6
Source Vendor ID: NMR/12689246