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6-PHENYL-7-METHYL-6-H-PYRROLO-[3.2-E]-2.1.3-BENZOXADIAZOLE
SpectraBase Compound ID JJpqfxLL1zz
InChI InChI=1S/C15H11N3O/c1-10-9-12-14(8-7-13-15(12)17-19-16-13)18(10)11-5-3-2-4-6-11/h2-9H,1H3
InChIKey LVQIYCDNKKYDRW-UHFFFAOYSA-N
Mol Weight 249.27 g/mol
Molecular Formula C15H11N3O
Exact Mass 249.090212 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BifWQRlCodk
Name 6-PHENYL-7-METHYL-6-H-PYRROLO-[3.2-E]-2.1.3-BENZOXADIAZOLE
Compound Number IV-B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H11N3O
InChI InChI=1S/C15H11N3O/c1-10-9-12-14(8-7-13-15(12)17-19-16-13)18(10)11-5-3-2-4-6-11/h2-9H,1H3
InChIKey LVQIYCDNKKYDRW-UHFFFAOYSA-N
Literature Reference Author V.A.SAMSONOV,L.B.VOLODARSKII
Literature Reference Citation CHEM.HET.COMP.,34,271(1998)
Literature Reference DOI 10.1007/bf02290715
Molecular Weight 249.272 g/mol
Solvent CDCl3
Source File Reference UWMZ14492