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1-(2-Phenylmethylquinazolin-4-yl)-2-naphthyl(trifluoromethyl)sulfonate
SpectraBase Compound ID KQBlOaBuGlk
InChI InChI=1S/C26H17F3N2O3S/c27-26(28,29)35(32,33)34-22-15-14-18-10-4-5-11-19(18)24(22)25-20-12-6-7-13-21(20)30-23(31-25)16-17-8-2-1-3-9-17/h1-15H,16H2
InChIKey PTHWNUOXFQKVGI-UHFFFAOYSA-N
Mol Weight 494.49 g/mol
Molecular Formula C26H17F3N2O3S
Exact Mass 494.091198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2dk4CyjcFQR
Name 1-(2-Phenylmethylquinazolin-4-yl)-2-naphthyl(trifluoromethyl)sulfonate
Alternate Name(s) 1-(2-benzyl-4-quinazolinyl)-2-naphthyl trifluoromethanesulfonate Trifluoromethanesulfonic acid[1-(2-benzylquinazolin-4-yl)-2-naphthyl]ester Trifluoromethanesulfonic acid[1-[2-(phenylmethyl)-4-quinazolinyl]-2-naphthalenyl]ester [1-(2-benzylquinazolin-4-yl)-2-naphthyl]trifluoromethanesulfonate [1-(2-benzylquinazolin-4-yl)naphthalen-2-yl]trifluoromethanesulfonate [1-[2-(phenylmethyl)quinazolin-4-yl]naphthalen-2-yl]tris(fluoranyl)methanesulfonate Trifluoromethanesulfonic acid [1-[2-(phenylmethyl)-4-quinazolinyl]-2-naphthalenyl] ester [1-(2-benzylquinazolin-4-yl)naphthalen-2-yl] trifluoromethanesulfonate [1-(2-benzylquinazolin-4-yl)-2-naphthyl] trifluoromethanesulfonate [1-[2-(phenylmethyl)quinazolin-4-yl]naphthalen-2-yl] tris(fluoranyl)methanesulfonate
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Formula C26H17F3N2O3S
InChI InChI=1S/C26H17F3N2O3S/c27-26(28,29)35(32,33)34-22-15-14-18-10-4-5-11-19(18)24(22)25-20-12-6-7-13-21(20)30-23(31-25)16-17-8-2-1-3-9-17/h1-15H,16H2
InChIKey PTHWNUOXFQKVGI-UHFFFAOYSA-N
Molecular Weight 494.488 g/mol
SMILES C(S(Oc1c(-c2nc(Cc3ccccc3)nc3c2cccc3)c2ccccc2cc1)(=O)=O)(F)(F)F
SPLASH splash10-03dl-9608100000-18eaea9a6b0a934e7c66
Source of Spectrum F-69-6583-13
Wiley ID 1595637