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2-[(5-tert-butyl-4H-1,2,4-triazol-3-yl)thio]-5-nitrothiazole

View entire compound with spectra: 3 NMR, and 1 FTIR

2-[(5-tert-butyl-4H-1,2,4-triazol-3-yl)thio]-5-nitrothiazole
SpectraBase Compound ID SEBfq2ax5q
InChI InChI=1S/C9H11N5O2S2/c1-9(2,3)6-11-7(13-12-6)18-8-10-4-5(17-8)14(15)16/h4H,1-3H3,(H,11,12,13)
InChIKey QGUZNPFKHBWXHD-UHFFFAOYSA-N
Mol Weight 285.34 g/mol
Molecular Formula C9H11N5O2S2
Exact Mass 285.035417 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KwED3tfn9Oy
Name 2-[(5-tert-BUTYL-4H-1,2,4-TRIAZOL-3-YL)THIO]-5-NITROTHIAZOLE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H11N5O2S2
InChI InChI=1S/C9H11N5O2S2/c1-9(2,3)6-11-7(13-12-6)18-8-10-4-5(17-8)14(15)16/h4H,1-3H3,(H,11,12,13)
InChIKey QGUZNPFKHBWXHD-UHFFFAOYSA-N
Melting Point 225-228C
Molecular Weight 285.35
Solvent Polysol; Reference=TMS Spectrometer= Bruker AC-300
Synonyms THIAZOLE, 2-[(5-tert-BUTYL-4H-1,2,4-TRIAZOL-3-YL)THIO]-5-NITRO-,