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3',5-Dimethyl-2-(p-tolyl)-5'-thioxo-[4,4'-bis(1,2,4)-triazol]-3(1'H,2H)-one
SpectraBase Compound ID 8HpOkp5MwIZ
InChI InChI=1S/C13H14N6OS/c1-8-4-6-11(7-5-8)17-13(20)19(10(3)16-17)18-9(2)14-15-12(18)21/h4-7H,1-3H3,(H,15,21)
InChIKey MFXCMEGPNBDZOX-UHFFFAOYSA-N
Mol Weight 302.36 g/mol
Molecular Formula C13H14N6OS
Exact Mass 302.09498 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EcO4t4S2iBd
Name 3',5-Dimethyl-2-(p-tolyl)-5'-thioxo-[4,4'-bis(1,2,4)-triazol]-3(1'H,2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N6OS
InChI InChI=1S/C13H14N6OS/c1-8-4-6-11(7-5-8)17-13(20)19(10(3)16-17)18-9(2)14-15-12(18)21/h4-7H,1-3H3,(H,15,21)
InChIKey MFXCMEGPNBDZOX-UHFFFAOYSA-N
Molecular Weight 302.356 g/mol
SMILES N1N=C(N(C1=S)N1C(N(c2ccc(cc2)C)N=C1C)=O)C
SPLASH splash10-02t9-1901000000-92261406d5a3e6199a84
Source of Spectrum QA-71-335-10
Wiley ID 1612105