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5-{[1-(2-methylbenzyl)-1H-pyrazol-4-yl]amino}-5-oxopentanoic acid
SpectraBase Compound ID Ah3j3wtCv00
InChI InChI=1S/C16H19N3O3/c1-12-5-2-3-6-13(12)10-19-11-14(9-17-19)18-15(20)7-4-8-16(21)22/h2-3,5-6,9,11H,4,7-8,10H2,1H3,(H,18,20)(H,21,22)
InChIKey YJSMDLKAQCUQRS-UHFFFAOYSA-N
Mol Weight 301.35 g/mol
Molecular Formula C16H19N3O3
Exact Mass 301.142641 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID rHIsK4vyTu
Name 5-{[1-(2-methylbenzyl)-1H-pyrazol-4-yl]amino}-5-oxopentanoic acid
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/C16H19N3O3/c1-12-5-2-3-6-13(12)10-19-11-14(9-17-19)18-15(20)7-4-8-16(21)22/h2-3,5-6,9,11H,4,7-8,10H2,1H3,(H,18,20)(H,21,22)
InChIKey YJSMDLKAQCUQRS-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_4115
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: UZI/9135496; Labnumber: BAM_UACK/002726; UZI_ID: UZI-004117
Temperature 318 °C