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Pyrimethamine

View entire compound with spectra: 4 NMR, 4 FTIR, 3 Raman, and 8 MS (GC)

Pyrimethamine
SpectraBase Compound ID DTg8AENB8dR
InChI InChI=1S/C12H13ClN4/c1-2-9-10(11(14)17-12(15)16-9)7-3-5-8(13)6-4-7/h3-6H,2H2,1H3,(H4,14,15,16,17)
InChIKey WKSAUQYGYAYLPV-UHFFFAOYSA-N
Mol Weight 248.72 g/mol
Molecular Formula C12H13ClN4
Exact Mass 248.082874 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4e6nuw0nCpK
Name PYRIMETHAMINE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H13ClN4
InChI InChI=1S/C12H13ClN4/c1-2-9-10(11(14)17-12(15)16-9)7-3-5-8(13)6-4-7/h3-6H,2H2,1H3,(H4,14,15,16,17)
InChIKey WKSAUQYGYAYLPV-UHFFFAOYSA-N
Instrument Name GC
Molecular Weight 248.717 g/mol
SMILES Nc1nc(N)nc(c1-c1ccc(Cl)cc1)CC
SPLASH splash10-0002-3590000000-89c904a99f8fe1567389
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany