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6-methyl-2-(4-methylphenyl)-4,4-bis(trifluoromethyl)-1,4-dihydro-5-pyrimidinecarbonitrile

View entire compound with spectra: 1 NMR

6-methyl-2-(4-methylphenyl)-4,4-bis(trifluoromethyl)-1,4-dihydro-5-pyrimidinecarbonitrile
SpectraBase Compound ID 3BTs2C0PPk4
InChI InChI=1S/C15H11F6N3/c1-8-3-5-10(6-4-8)12-23-9(2)11(7-22)13(24-12,14(16,17)18)15(19,20)21/h3-6H,1-2H3,(H,23,24)
InChIKey GQTVLCXUNVMTSE-UHFFFAOYSA-N
Mol Weight 347.26 g/mol
Molecular Formula C15H11F6N3
Exact Mass 347.085716 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GurjA08Rtjo
Name 6-methyl-2-(4-methylphenyl)-4,4-bis(trifluoromethyl)-1,4-dihydro-5-pyrimidinecarbonitrile
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/C15H11F6N3/c1-8-3-5-10(6-4-8)12-23-9(2)11(7-22)13(24-12,14(16,17)18)15(19,20)21/h3-6H,1-2H3,(H,23,24)
InChIKey GQTVLCXUNVMTSE-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_5636
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: D23475; Labnumber: SOK-1334; SBI_ID: SBI-005638
Temperature 318 °C