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3-(Biphenyl-4-yl-methanoyl)-4-tert-butyl-2,3-dihydrothiazol-2-thione
SpectraBase Compound ID GigxEmFJDJf
InChI InChI=1S/C20H19NOS2/c1-20(2,3)17-13-24-19(23)21(17)18(22)16-11-9-15(10-12-16)14-7-5-4-6-8-14/h4-13H,1-3H3
InChIKey MIOQUXWLYJKDCZ-UHFFFAOYSA-N
Mol Weight 353.5 g/mol
Molecular Formula C20H19NOS2
Exact Mass 353.090807 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KAN6B8WpxVX
Name 3-(Biphenyl-4-yl-methanoyl)-4-tert-butyl-2,3-dihydrothiazol-2-thione
Alternate Name(s) [1,1'-biphenyl]-4-yl(4-(tert-butyl)-2-thioxothiazol-3(2H)-yl)methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19NOS2
InChI InChI=1S/C20H19NOS2/c1-20(2,3)17-13-24-19(23)21(17)18(22)16-11-9-15(10-12-16)14-7-5-4-6-8-14/h4-13H,1-3H3
InChIKey MIOQUXWLYJKDCZ-UHFFFAOYSA-N
Literature Reference DOI 10.1002_(SICI)1521-3897(200004)342_4_355
Molecular Weight 353.498 g/mol
SMILES C=1(N(C(SC1)=S)C(c1ccc(cc1)-c1ccccc1)=O)C(C)(C)C
SPLASH splash10-0f89-0900000000-b33a63484713a7c8e989
Source of Spectrum JF-342-363-7c
Wiley ID 1766958