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1H-1,2,4-Triazole, 1,1'-ethylidenebis[3-(methylthio)-
SpectraBase Compound ID 3QLL7pCTpBd
InChI InChI=1S/C8H12N6S2/c1-6(13-4-9-7(11-13)15-2)14-5-10-8(12-14)16-3/h4-6H,1-3H3
InChIKey JYDHGWDUSGATDB-UHFFFAOYSA-N
Mol Weight 256.35 g/mol
Molecular Formula C8H12N6S2
Exact Mass 256.056487 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DxwYxTjsdTl
Name 1H-1,2,4-Triazole, 1,1'-ethylidenebis[3-(methylthio)-
Alternate Name(s) 2,2-bis(3-methylthio-1H-1,2,4-triazol-1-yl)ethane 3-(methylsulfanyl)-1-{1-[3-(methylsulfanyl)-1H-1,2,4-triazol-1-yl]ethyl}-1H-1,2,4-triazole
CAS Registry Number 118718-14-2
Comments Less than 3 mono-isotopic peaks
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Formula C8H12N6S2
InChI InChI=1S/C8H12N6S2/c1-6(13-4-9-7(11-13)15-2)14-5-10-8(12-14)16-3/h4-6H,1-3H3
InChIKey JYDHGWDUSGATDB-UHFFFAOYSA-N
Molecular Weight 256.346 g/mol
SMILES c1(n[n](cn1)C([n]1nc(SC)nc1)C)SC
SPLASH splash10-0006-0920000000-cfd6d2d10e22cd55e2c8
Source of Spectrum KC-1988-1901-6
Wiley ID 1259161