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

*Links on SpectraBase are not permalinks.
6-Benzylsulfanyl-2-methyl-5-trifluoromethyl-pyrimidin-4-ylamine
SpectraBase Compound ID 6rH2z7bVa1o
InChI InChI=1S/C13H12F3N3S/c1-8-18-11(17)10(13(14,15)16)12(19-8)20-7-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H2,17,18,19)
InChIKey AALGUWXKEYIPIH-UHFFFAOYSA-N
Mol Weight 299.32 g/mol
Molecular Formula C13H12F3N3S
Exact Mass 299.070403 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 GyCGTJjB0O5
Name 6-Benzylsulfanyl-2-methyl-5-trifluoromethyl-pyrimidin-4-ylamine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12F3N3S
InChI InChI=1S/C13H12F3N3S/c1-8-18-11(17)10(13(14,15)16)12(19-8)20-7-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H2,17,18,19)
InChIKey AALGUWXKEYIPIH-UHFFFAOYSA-N
Molecular Weight 299.315 g/mol
SMILES Nc1nc(nc(c1C(F)(F)F)SCc1ccccc1)C
SPLASH splash10-00ko-9320000000-05fcd4d4a03f3eb91c1c
Synonyms 2-Methyl-6-(phenylmethylsulfanyl)-5-(trifluoromethyl)pyrimidin-4-amine 2-Methyl-6-(phenylmethylthio)-5-(trifluoromethyl)-4-pyrimidinamine 6-(Benzylsulfanyl)-2-methyl-5-(trifluoromethyl)-4-pyrimidinylamine 6-Benzylsulfanyl-2-methyl-5-(trifluoromethyl)pyrimidin-4-amine [6-(benzylthio)-2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]amine
Wiley ID 1464353