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5-CHLORO-2-METHYLTHIO-CYCLOPENTA-[D]-[1,2,4]-TRIAZOLO-[1,5-A]-PYRIMIDINE
SpectraBase Compound ID IWFboftKPZs
InChI InChI=1S/C9H9ClN4S/c1-15-9-12-8-11-6-4-2-3-5(6)7(10)14(8)13-9/h2-4H2,1H3
InChIKey NYLPWBKCOGRXNN-UHFFFAOYSA-N
Mol Weight 240.71 g/mol
Molecular Formula C9H9ClN4S
Exact Mass 240.023645 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6pNCOyJ60nx
Name 5-Chloro-7-methyl-2-methylthio-8H-cyclopenta[1,2-d][1,2,4]-triazolo[1,5-a]pyrimidine
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9ClN4S
InChI InChI=1S/C9H9ClN4S/c1-15-9-12-8-11-6-4-2-3-5(6)7(10)14(8)13-9/h2-4H2,1H3
InChIKey NYLPWBKCOGRXNN-UHFFFAOYSA-N
Molecular Weight 240.712 g/mol
SMILES c12[n](nc(n2)SC)C(=C2C(=N1)CCC2)Cl
SPLASH splash10-0006-0290000000-c3fdd84371c87e134580
Source of Spectrum Y-34-1522-5
Synonyms 8-Chloro-2-methylthio-6,7-dihydro-5H-cyclopenta[d][1,2,4]-triazolo[1,5-a]pyrimidine
Wiley ID 1242363