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Ethanone, [4,5-dihydro-4-tert-butyl-1-(4-methylphenyl)-5-(2-thienyl)-1H-1,2,4-triazol-3-yl]-
SpectraBase Compound ID 3nmWGNtxYqM
InChI InChI=1S/C19H23N3OS/c1-13-8-10-15(11-9-13)22-18(16-7-6-12-24-16)21(19(3,4)5)17(20-22)14(2)23/h6-12,18H,1-5H3
InChIKey NPPSJUDUDJNUJJ-UHFFFAOYSA-N
Mol Weight 341.47 g/mol
Molecular Formula C19H23N3OS
Exact Mass 341.156184 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B6okdEIvOwM
Name Ethanone, [4,5-dihydro-4-tert-butyl-1-(4-methylphenyl)-5-(2-thienyl)-1H-1,2,4-triazol-3-yl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H23N3OS
InChI InChI=1S/C19H23N3OS/c1-13-8-10-15(11-9-13)22-18(16-7-6-12-24-16)21(19(3,4)5)17(20-22)14(2)23/h6-12,18H,1-5H3
InChIKey NPPSJUDUDJNUJJ-UHFFFAOYSA-N
Molecular Weight 341.473 g/mol
SMILES Cc1ccc(N2C(N(C(=N2)C(=O)C)C(C)(C)C)c2sccc2)cc1
SPLASH splash10-0016-7390000000-e8b95e5371abec553968
Synonyms 1-[4-tert-Butyl-1-(4-methylphenyl)-5-(2-thienyl)-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethanone 1-[4-tert-butyl-2-(4-methylphenyl)-3-thiophen-2-yl-3H-1,2,4-triazol-5-yl]ethanone 1-[4-tert-butyl-2-(p-tolyl)-3-(2-thienyl)-3H-1,2,4-triazol-5-yl]ethanone
Wiley ID 1455426