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4-Phenyl-5,5-dimethyl-1,2,4-(4H)-triazole-3(5H)-thione

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

4-Phenyl-5,5-dimethyl-1,2,4-(4H)-triazole-3(5H)-thione
SpectraBase Compound ID CbOzdrOA9YJ
InChI InChI=1S/C10H11N3S/c1-10(2)12-11-9(14)13(10)8-6-4-3-5-7-8/h3-7H,1-2H3
InChIKey VWIOFPCPXHPMCO-UHFFFAOYSA-N
Mol Weight 205.28 g/mol
Molecular Formula C10H11N3S
Exact Mass 205.067369 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID HyYzCNhvaQo
Name delta1-1,2,4-Triazoline-3-thione, 5,5-dimethyl-4-phenyl-
CAS Registry Number 25687-97-2
Copyright Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H11N3S
InChI InChI=1S/C10H11N3S/c1-10(2)12-11-9(14)13(10)8-6-4-3-5-7-8/h3-7H,1-2H3
InChIKey VWIOFPCPXHPMCO-UHFFFAOYSA-N
Instrument Name Bruker IFS 85
Purity slightly contaminated
Synonyms 3H-1,2,4-Triazole-3-thione, 4,5-dihydro-5,5-dimethyl-4-phenyl- 4-Phenyl-5,5-dimethyl-1,2,4-(4H)-triazole-3(5H)-thione
Technique KBr-Pellet