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4'-chloro-1'-(3,4-dichlorobenzyl)-1,1''-dimethyl-1H,1'H,1''H-4,3':5',4''-terpyrazole

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4'-chloro-1'-(3,4-dichlorobenzyl)-1,1''-dimethyl-1H,1'H,1''H-4,3':5',4''-terpyrazole
SpectraBase Compound ID GfRPImdItKV
InChI InChI=1S/C18H15Cl3N6/c1-25-9-12(6-22-25)17-16(21)18(13-7-23-26(2)10-13)27(24-17)8-11-3-4-14(19)15(20)5-11/h3-7,9-10H,8H2,1-2H3
InChIKey RFTWKQJKFLYEPQ-UHFFFAOYSA-N
Mol Weight 421.72 g/mol
Molecular Formula C18H15Cl3N6
Exact Mass 420.042378 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7kgOI6D5R6V
Name 4'-chloro-1'-(3,4-dichlorobenzyl)-1,1''-dimethyl-1H,1'H,1''H-4,3':5',4''-terpyrazole
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/C18H15Cl3N6/c1-25-9-12(6-22-25)17-16(21)18(13-7-23-26(2)10-13)27(24-17)8-11-3-4-14(19)15(20)5-11/h3-7,9-10H,8H2,1-2H3
InChIKey RFTWKQJKFLYEPQ-UHFFFAOYSA-N
NMR Offset 17.912
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_31294
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: 1761133; SBI_ID: SBI-031298
Temperature 303 °C