For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Ethyl 7-(2-fluorophenyl)-2-methylthio-5-trifluoromethyl-4,7-dihydro-1,2,4-triazolo[1,5-a]pyrimidine-6-carboxylate
SpectraBase Compound ID 7USKtZR34bP
InChI InChI=1S/C16H14F4N4O2S/c1-3-26-13(25)10-11(8-6-4-5-7-9(8)17)24-14(22-15(23-24)27-2)21-12(10)16(18,19)20/h4-7,11H,3H2,1-2H3,(H,21,22,23)
InChIKey BJEWEOKVPQDUAO-UHFFFAOYSA-N
Mol Weight 402.37 g/mol
Molecular Formula C16H14F4N4O2S
Exact Mass 402.07736 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9H5IScilufT
Name Ethyl 7-(2-fluorophenyl)-2-methylthio-5-trifluoromethyl-4,7-dihydro-1,2,4-triazolo[1,5-a]pyrimidine-6-carboxylate
Alternate Name(s) Ethyl 7-(2-fluorophenyl)-2-methylsulfanyl-5-(trifluoromethyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14F4N4O2S
InChI InChI=1S/C16H14F4N4O2S/c1-3-26-13(25)10-11(8-6-4-5-7-9(8)17)24-14(22-15(23-24)27-2)21-12(10)16(18,19)20/h4-7,11H,3H2,1-2H3,(H,21,22,23)
InChIKey BJEWEOKVPQDUAO-UHFFFAOYSA-N
Molecular Weight 402.368 g/mol
SMILES N1c2[n](C(C(=C1C(F)(F)F)C(=O)OCC)c1c(F)cccc1)nc(n2)SC
SPLASH splash10-0g4r-0912100000-91f1fb8dfaabd0fdbf91
Source of Spectrum Y-46-146-5t
Wiley ID 1666699