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5-(methylthio)-7-spiro[1H-[1,2,4]triazolo[1,5-a][1,3,5]triazine-2,1'-cyclohexane]amine
SpectraBase Compound ID 2i27gByiTwO
InChI InChI=1S/C10H16N6S/c1-17-9-12-7(11)16-8(13-9)14-10(15-16)5-3-2-4-6-10/h15H,2-6H2,1H3,(H2,11,12,13,14)
InChIKey CLIBGGMQMRKVFW-UHFFFAOYSA-N
Mol Weight 252.34 g/mol
Molecular Formula C10H16N6S
Exact Mass 252.115716 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jd5FkUzPWlH
Name 5-(methylthio)-7-spiro[1H-[1,2,4]triazolo[1,5-a][1,3,5]triazine-2,1'-cyclohexane]amine
Alternate Name(s) 5-methylsulfanylspiro[1H-[1,2,4]triazolo[1,5-a][1,3,5]triazine-2,1'-cyclohexane]-7-amine [5-(methylthio)spiro[1H-[1,2,4]triazolo[1,5-a][1,3,5]triazine-2,1'-cyclohexane]-7-yl]amine
Comments Less than 3 mono-isotopic peaks
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Formula C10H16N6S
InChI InChI=1S/C10H16N6S/c1-17-9-12-7(11)16-8(13-9)14-10(15-16)5-3-2-4-6-10/h15H,2-6H2,1H3,(H2,11,12,13,14)
InChIKey CLIBGGMQMRKVFW-UHFFFAOYSA-N
Molecular Weight 252.340 g/mol
SMILES NC1=NC(=NC=2N1NC1(N2)CCCCC1)SC
SPLASH splash10-0002-0920000000-2ee73c90fa95c8655db5
Source of Spectrum Y-20-1588-10
Wiley ID 818110