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1-(7-Chloro-2-methylquinazolin-4-yl)naphthalen-2-yl Trifluoromethanesulfonate
SpectraBase Compound ID 4PghXiKWUGh
InChI InChI=1S/C20H12ClF3N2O3S/c1-11-25-16-10-13(21)7-8-15(16)19(26-11)18-14-5-3-2-4-12(14)6-9-17(18)29-30(27,28)20(22,23)24/h2-10H,1H3
InChIKey CNPIFNMNSUYJCE-UHFFFAOYSA-N
Mol Weight 452.84 g/mol
Molecular Formula C20H12ClF3N2O3S
Exact Mass 452.020926 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HHuqTxRDH9b
Name 1-(7-Chloro-2-methylquinazolin-4-yl)naphthalen-2-yl Trifluoromethanesulfonate
Comments Less than 3 mono-isotopic peaks
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Formula C20H12ClF3N2O3S
InChI InChI=1S/C20H12ClF3N2O3S/c1-11-25-16-10-13(21)7-8-15(16)19(26-11)18-14-5-3-2-4-12(14)6-9-17(18)29-30(27,28)20(22,23)24/h2-10H,1H3
InChIKey CNPIFNMNSUYJCE-UHFFFAOYSA-N
Molecular Weight 452.835 g/mol
SMILES C(S(Oc1c(-c2c3c(cc(cc3)Cl)nc(n2)C)c2ccccc2cc1)(=O)=O)(F)(F)F
SPLASH splash10-0zfr-0000900000-98c51b0f21ab2c52e469
Source of Spectrum U1-2010-6002-22
Synonyms trifluoromethanesulfonic acid [1-(7-chloro-2-methyl-4-quinazolinyl)-2-naphthalenyl] ester [1-(7-chloro-2-methylquinazolin-4-yl)naphthalen-2-yl] trifluoromethanesulfonate [1-(7-chloro-2-methyl-quinazolin-4-yl)-2-naphthyl] trifluoromethanesulfonate [1-(7-chloranyl-2-methyl-quinazolin-4-yl)naphthalen-2-yl] tris(fluoranyl)methanesulfonate
Wiley ID 1664456