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1-(alpha,alpha,alpha,alpha',alpha',alpha'-hexafluoro-3,5-xylyl)-2-phenyl-5,6,7,8-tetrahydro-4(1H)-quinazolinethione

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1-(alpha,alpha,alpha,alpha',alpha',alpha'-hexafluoro-3,5-xylyl)-2-phenyl-5,6,7,8-tetrahydro-4(1H)-quinazolinethione
SpectraBase Compound ID LbqdcMUq3OT
InChI InChI=1S/C22H16F6N2S/c23-21(24,25)14-10-15(22(26,27)28)12-16(11-14)30-18-9-5-4-8-17(18)20(31)29-19(30)13-6-2-1-3-7-13/h1-3,6-7,10-12H,4-5,8-9H2
InChIKey MMRGHVBCJMWMRC-UHFFFAOYSA-N
Mol Weight 454.43 g/mol
Molecular Formula C22H16F6N2S
Exact Mass 454.093839 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Llv8ynEG2BE
Name 1-(alpha,alpha,alpha,alpha',alpha',alpha'-hexafluoro-3,5-xylyl)-2-phenyl-5,6,7,8-tetrahydro-4(1H)-quinazolinethione
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H16F6N2S
InChI InChI=1S/C22H16F6N2S/c23-21(24,25)14-10-15(22(26,27)28)12-16(11-14)30-18-9-5-4-8-17(18)20(31)29-19(30)13-6-2-1-3-7-13/h1-3,6-7,10-12H,4-5,8-9H2
InChIKey MMRGHVBCJMWMRC-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 35992M
Solvent CDCl3