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3-(PARA-CHLOROBENZOYL)-4,5,6,7-TETRAHYDRO-[1,2,3]-TRIAZOLO-[1,5-A]-PYRIMIDINE
SpectraBase Compound ID B3Jqz4oaocc
InChI InChI=1S/C12H11ClN4O/c13-9-4-2-8(3-5-9)11(18)10-12-14-6-1-7-17(12)16-15-10/h2-5,14H,1,6-7H2
InChIKey RDOCTKJTZZDFAP-UHFFFAOYSA-N
Mol Weight 262.7 g/mol
Molecular Formula C12H11ClN4O
Exact Mass 262.062139 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J25ohw1DIFP
Name 3-(PARA-CHLOROBENZOYL)-4,5,6,7-TETRAHYDRO-[1,2,3]-TRIAZOLO-[1,5-A]-PYRIMIDINE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H11ClN4O
InChI InChI=1S/C12H11ClN4O/c13-9-4-2-8(3-5-9)11(18)10-12-14-6-1-7-17(12)16-15-10/h2-5,14H,1,6-7H2
InChIKey RDOCTKJTZZDFAP-UHFFFAOYSA-N
Literature Reference Author Z.T.HUANG,M.X.WANG
Literature Reference Citation J.ORG.CHEM.,57,184(1992)
Literature Reference DOI 10.1021/jo00027a035
Molecular Weight 262.699 g/mol
Solvent CDCl3
Source File Reference UWCS2133