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5-METHYL-3-[PARA-(5'-(4-BROMOPHENYL)-4',5'-DIHYDRO-DELTA(2)-ISOXAZOL-3'-YL)-PHENYL]-3H-2-OXO-DELTA(4)-1,3,4-OXADIAZOLE
SpectraBase Compound ID 7d2lS6Q77Ox
InChI InChI=1S/C18H14BrN3O3/c1-11-20-22(18(23)24-11)15-8-4-12(5-9-15)16-10-17(25-21-16)13-2-6-14(19)7-3-13/h2-9,17H,10H2,1H3
InChIKey OOOIOFLROXRNBC-UHFFFAOYSA-N
Mol Weight 400.23 g/mol
Molecular Formula C18H14BrN3O3
Exact Mass 399.021854 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AJQ32fjzvaT
Name 5-METHYL-3-[PARA-(5'-(4-BROMOPHENYL)-4',5'-DIHYDRO-DELTA(2)-ISOXAZOL-3'-YL)-PHENYL]-3H-2-OXO-DELTA(4)-1,3,4-OXADIAZOLE
Compound Number 6E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H14BrN3O3
InChI InChI=1S/C18H14BrN3O3/c1-11-20-22(18(23)24-11)15-8-4-12(5-9-15)16-10-17(25-21-16)13-2-6-14(19)7-3-13/h2-9,17H,10H2,1H3
InChIKey OOOIOFLROXRNBC-UHFFFAOYSA-N
Literature Reference Author R.R.KAMBLE,B.S.SUDHA
Literature Reference Citation J.HETCYCL.CHEM.,43,345(2006)
Literature Reference DOI 10.1002/jhet.5570430214
Molecular Weight 400.231 g/mol
Sample ID 67266
Solvent Unknown