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Pteridine, 2-(methylthio)-4-(trifluoromethyl)-
SpectraBase Compound ID DdQa4xRuZ2P
InChI InChI=1S/C8H5F3N4S/c1-16-7-14-5(8(9,10)11)4-6(15-7)13-3-2-12-4/h2-3H,1H3
InChIKey FIETVGJWISTLQV-UHFFFAOYSA-N
Mol Weight 246.21 g/mol
Molecular Formula C8H5F3N4S
Exact Mass 246.018702 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JxMDavYgroS
Name Pteridine, 2-(methylthio)-4-(trifluoromethyl)-
CAS Registry Number 32710-61-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H5F3N4S
InChI InChI=1S/C8H5F3N4S/c1-16-7-14-5(8(9,10)11)4-6(15-7)13-3-2-12-4/h2-3H,1H3
InChIKey FIETVGJWISTLQV-UHFFFAOYSA-N
Molecular Weight 246.211 g/mol
SMILES CSc1nc(c2c(nccn2)n1)C(F)(F)F
SPLASH splash10-0f6t-9740000000-965a6870b5d57454b62b
Source of Spectrum O-5-1424-2
Synonyms 2-(Methylsulfanyl)-4-(trifluoromethyl)pteridine 2-(methylthio)-4-(trifluoromethyl)pteridine
Wiley ID 34055