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Ethyl 5-amino-1-(4-[chloro(difluoro)methoxy]phenyl)-1H-pyrazole-4-carboxylate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Ethyl 5-amino-1-(4-[chloro(difluoro)methoxy]phenyl)-1H-pyrazole-4-carboxylate
SpectraBase Compound ID LQrJtUNpztJ
InChI InChI=1S/C13H12ClF2N3O3/c1-2-21-12(20)10-7-18-19(11(10)17)8-3-5-9(6-4-8)22-13(14,15)16/h3-7H,2,17H2,1H3
InChIKey MYARUKRSKKDEHE-UHFFFAOYSA-N
Mol Weight 331.71 g/mol
Molecular Formula C13H12ClF2N3O3
Exact Mass 331.053525 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 68DVgV3oo6t
Name 1H-pyrazole-4-carboxylic acid, 5-amino-1-[4-(chlorodifluoromethoxy)phenyl]-, ethyl ester
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/C13H12ClF2N3O3/c1-2-21-12(20)10-7-18-19(11(10)17)8-3-5-9(6-4-8)22-13(14,15)16/h3-7H,2,17H2,1H3
InChIKey MYARUKRSKKDEHE-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_7703
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: ZERO/001769; IOH_ID: IOH-014708