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5-(4-isopropylthiazol-2-yl)-4-phenyl-4H-1,2,4-triazole-3-thiol

View entire compound with spectra: 1 MS (GC)

5-(4-isopropylthiazol-2-yl)-4-phenyl-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID KFwfaQa4hU9
InChI InChI=1S/C14H14N4S2/c1-9(2)11-8-20-13(15-11)12-16-17-14(19)18(12)10-6-4-3-5-7-10/h3-9H,1-2H3,(H,17,19)
InChIKey SAFUTMRAIHMVHA-UHFFFAOYSA-N
Mol Weight 302.41 g/mol
Molecular Formula C14H14N4S2
Exact Mass 302.065989 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E92ngrNdCJH
Name 5-(4-isopropylthiazol-2-yl)-4-phenyl-4H-1,2,4-triazole-3-thiol
Comments Less than 3 mono-isotopic peaks
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Formula C14H14N4S2
InChI InChI=1S/C14H14N4S2/c1-9(2)11-8-20-13(15-11)12-16-17-14(19)18(12)10-6-4-3-5-7-10/h3-9H,1-2H3,(H,17,19)
InChIKey SAFUTMRAIHMVHA-UHFFFAOYSA-N
Molecular Weight 302.414 g/mol
SMILES Sc1[n](c(-c2nc(C(C)C)cs2)nn1)-c1ccccc1
SPLASH splash10-0udi-0009000000-b43ed226662e911826d2
Source of Spectrum F2-45-2073-8
Synonyms 4-phenyl-3-(4-propan-2-yl-2-thiazolyl)-1H-1,2,4-triazole-5-thione 4-phenyl-3-(4-propan-2-yl-1,3-thiazol-2-yl)-1H-1,2,4-triazole-5-thione
Wiley ID 1688859