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4-[(1-Phenylvinyl)carbonyl]-5-[(5'-phenyl-2(2H)-tetrazolyl)methyl]-1,2,4(4H)-triazole-3-thione
SpectraBase Compound ID KZ012eY6RqJ
InChI InChI=1S/C19H15N7OS/c1-13(14-8-4-2-5-9-14)18(27)26-16(20-22-19(26)28)12-25-23-17(21-24-25)15-10-6-3-7-11-15/h2-11H,1,12H2,(H,22,28)
InChIKey XJNLDJZQVWOBNO-UHFFFAOYSA-N
Mol Weight 389.44 g/mol
Molecular Formula C19H15N7OS
Exact Mass 389.105879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HuUrQn09ZIB
Name 4-[(1-Phenylvinyl)carbonyl]-5-[(5'-phenyl-2(2H)-tetrazolyl)methyl]-1,2,4(4H)-triazole-3-thione
Alternate Name(s) 4-(2-phenylacryloyl)-5-[(5-phenyl-2H-tetraazol-2-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione 4-[(Phenylvinyl)carbonyl]-5-[(5'-phenyl-2(2H)-tetrazolyl)methyl]-1,2,4(4H)-triazole-3-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H15N7OS
InChI InChI=1S/C19H15N7OS/c1-13(14-8-4-2-5-9-14)18(27)26-16(20-22-19(26)28)12-25-23-17(21-24-25)15-10-6-3-7-11-15/h2-11H,1,12H2,(H,22,28)
InChIKey XJNLDJZQVWOBNO-UHFFFAOYSA-N
Molecular Weight 389.437 g/mol
SMILES N1N=C(N(C1=S)C(C(c1ccccc1)=C)=O)C[n]1nc(-c2ccccc2)nn1
SPLASH splash10-004i-5900000000-eaaf91b7471104c7a934
Source of Spectrum OP-24-494-2
Wiley ID 850392