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2-Chloro-4,5-difluoro-benzoic acid 2-methoxy-4-[(1H-tetrazol-5-yl)-hydrazonomethyl]-phenyl ester
SpectraBase Compound ID 4axLi96r6qj
InChI InChI=1S/C16H11ClF2N6O3/c1-27-14-4-8(7-20-21-16-22-24-25-23-16)2-3-13(14)28-15(26)9-5-11(18)12(19)6-10(9)17/h2-7H,1H3,(H2,21,22,23,24,25)/b20-7+
InChIKey JAMCRZRCLOCYEC-IFRROFPPSA-N
Mol Weight 408.75 g/mol
Molecular Formula C16H11ClF2N6O3
Exact Mass 408.054922 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2irgH07dQGK
Name 2-methoxy-4-[(E)-(1H-tetraazol-5-ylhydrazono)methyl]phenyl 2-chloro-4,5-difluorobenzoate
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/C16H11ClF2N6O3/c1-27-14-4-8(7-20-21-16-22-24-25-23-16)2-3-13(14)28-15(26)9-5-11(18)12(19)6-10(9)17/h2-7H,1H3,(H2,21,22,23,24,25)/b20-7+
InChIKey JAMCRZRCLOCYEC-IFRROFPPSA-N
NMR Offset 16.1752
NMR Spectrometer Frequency 200.133
Observed nucleus 1H
Origin 1H_ASIOH_7529_1779
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: NMR/9245172; Labnumber: SAD-0000396
Temperature 313 °C