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5-{[4-chloro-1-(2-chlorobenzyl)-1H-pyrazol-3-yl]amino}-5-oxopentanoic acid
SpectraBase Compound ID 6DVDebjvJiv
InChI InChI=1S/C15H15Cl2N3O3/c16-11-5-2-1-4-10(11)8-20-9-12(17)15(19-20)18-13(21)6-3-7-14(22)23/h1-2,4-5,9H,3,6-8H2,(H,22,23)(H,18,19,21)
InChIKey HBWUNOJNHZUFSN-UHFFFAOYSA-N
Mol Weight 356.21 g/mol
Molecular Formula C15H15Cl2N3O3
Exact Mass 355.049047 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Fh3Pr1fwhgC
Name 5-{[4-chloro-1-(2-chlorobenzyl)-1H-pyrazol-3-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/C15H15Cl2N3O3/c16-11-5-2-1-4-10(11)8-20-9-12(17)15(19-20)18-13(21)6-3-7-14(22)23/h1-2,4-5,9H,3,6-8H2,(H,22,23)(H,18,19,21)
InChIKey HBWUNOJNHZUFSN-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_31852
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: 1843445; SBI_ID: SBI-031856
Temperature 315 °C