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1'-(4-cyclopropyl-6-(difluoromethyl)pyrimidin-2-yl)-1,1'',4',5,5''-pentamethyl-1H,1'H,1''H-4,3':5',4''-terpyrazole

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1'-(4-cyclopropyl-6-(difluoromethyl)pyrimidin-2-yl)-1,1'',4',5,5''-pentamethyl-1H,1'H,1''H-4,3':5',4''-terpyrazole
SpectraBase Compound ID AjCM5IN4SoL
InChI InChI=1S/C22H24F2N8/c1-11-19(15-9-25-30(4)12(15)2)29-32(20(11)16-10-26-31(5)13(16)3)22-27-17(14-6-7-14)8-18(28-22)21(23)24/h8-10,14,21H,6-7H2,1-5H3
InChIKey COXLPTKUPRAWMW-UHFFFAOYSA-N
Mol Weight 438.49 g/mol
Molecular Formula C22H24F2N8
Exact Mass 438.209199 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 12IwclJMBTc
Name 1'-(4-cyclopropyl-6-(difluoromethyl)pyrimidin-2-yl)-1,1'',4',5,5''-pentamethyl-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/C22H24F2N8/c1-11-19(15-9-25-30(4)12(15)2)29-32(20(11)16-10-26-31(5)13(16)3)22-27-17(14-6-7-14)8-18(28-22)21(23)24/h8-10,14,21H,6-7H2,1-5H3
InChIKey COXLPTKUPRAWMW-UHFFFAOYSA-N
NMR Offset 17.9096
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_31328
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: 1766928; SBI_ID: SBI-031332
Temperature 303 °C