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4-[2-[[4-[4-(Trifluoromethyl)phenoxy]phenyl]thio]ethyl]quinazoline
SpectraBase Compound ID 411GQd1t1eW
InChI InChI=1S/C23H17F3N2OS/c24-23(25,26)16-5-7-17(8-6-16)29-18-9-11-19(12-10-18)30-14-13-22-20-3-1-2-4-21(20)27-15-28-22/h1-12,15H,13-14H2
InChIKey BVPFIYDFOBCIAC-UHFFFAOYSA-N
Mol Weight 426.46 g/mol
Molecular Formula C23H17F3N2OS
Exact Mass 426.101369 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8aX7TEQUl5I
Name 4-[2-[[4-[4-(Trifluoromethyl)phenoxy]phenyl]thio]ethyl]quinazoline
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H17F3N2OS
InChI InChI=1S/C23H17F3N2OS/c24-23(25,26)16-5-7-17(8-6-16)29-18-9-11-19(12-10-18)30-14-13-22-20-3-1-2-4-21(20)27-15-28-22/h1-12,15H,13-14H2
InChIKey BVPFIYDFOBCIAC-UHFFFAOYSA-N
Molecular Weight 426.457 g/mol
SMILES C(c1ccc(Oc2ccc(SCCc3c4c(cccc4)ncn3)cc2)cc1)(F)(F)F
SPLASH splash10-0006-9000000000-99a81e8a798a89cb017a
Source of Spectrum Y-34-1265-2
Wiley ID 1379888