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1-(4-METHOXYPHENYL)-2-(TETRAZOLO-[1,5-C]-QUINAZOLIN-5-YL-THIO)-ETHANONE
SpectraBase Compound ID Eg3SbQXdL3H
InChI InChI=1S/C17H13N5O2S/c1-24-12-8-6-11(7-9-12)15(23)10-25-17-18-14-5-3-2-4-13(14)16-19-20-21-22(16)17/h2-9H,10H2,1H3
InChIKey BXHZQWWTNZVSFC-UHFFFAOYSA-N
Mol Weight 351.38 g/mol
Molecular Formula C17H13N5O2S
Exact Mass 351.078996 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID NSWUKgOGXb
Name 1-(4-METHOXYPHENYL)-2-(TETRAZOLO-[1,5-C]-QUINAZOLIN-5-YL-THIO)-ETHANONE
Compound Number 5.3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H13N5O2S
InChI InChI=1S/C17H13N5O2S/c1-24-12-8-6-11(7-9-12)15(23)10-25-17-18-14-5-3-2-4-13(14)16-19-20-21-22(16)17/h2-9H,10H2,1H3
InChIKey BXHZQWWTNZVSFC-UHFFFAOYSA-N
Literature Reference Author L.M.ANTYPENKO,S.I.KOVALENKO,O.M.ANTYPENKO,A.M.KATSEV,O.M.ACH KASOVA
Literature Reference Citation SCI.PHARM.,81,15(2013)
Literature Reference DOI 10.3797/scipharm.1208-13
Molecular Weight 351.383 g/mol
Sample ID 73539
Solvent DMSO-D6