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3-(Methylthio)-6-(1-propylcyclohexyl)-1,2,4,5-tetrazine
SpectraBase Compound ID 6jOe6KqNJZ3
InChI InChI=1S/C12H20N4S/c1-3-7-12(8-5-4-6-9-12)10-13-15-11(17-2)16-14-10/h3-9H2,1-2H3
InChIKey QKYZAVVMOVUKLP-UHFFFAOYSA-N
Mol Weight 252.38 g/mol
Molecular Formula C12H20N4S
Exact Mass 252.140868 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BtwwazshtMu
Name 3-(Methylthio)-6-(1-propylcyclohexyl)-1,2,4,5-tetrazine
Comments Less than 3 mono-isotopic peaks
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Formula C12H20N4S
InChI InChI=1S/C12H20N4S/c1-3-7-12(8-5-4-6-9-12)10-13-15-11(17-2)16-14-10/h3-9H2,1-2H3
InChIKey QKYZAVVMOVUKLP-UHFFFAOYSA-N
Molecular Weight 252.380 g/mol
SMILES c1(nnc(nn1)SC)C1(CCC)CCCCC1
SPLASH splash10-0ur0-9090000000-fb63e3144e394619632f
Source of Spectrum J-59-8287-20
Synonyms 3-methylsulfanyl-6-(1-propylcyclohexyl)-1,2,4,5-tetrazine
Wiley ID 1255254