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N-PENTYL-2-METHYLBENZOXAZOLIUM-QUATERNARY-IODIDE
SpectraBase Compound ID IOi3IHvCMHa
InChI InChI=1S/C13H18NO.HI/c1-3-4-7-10-14-11(2)15-13-9-6-5-8-12(13)14;/h5-6,8-9H,3-4,7,10H2,1-2H3;1H/q+1;/p-1
InChIKey YUSTVUCWDLHBRB-UHFFFAOYSA-M
Mol Weight 331.2 g/mol
Molecular Formula C13H18INO
Exact Mass 331.043309 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IAUwKcE4d7m
Name N-PENTYL-2-METHYLBENZOXAZOLIUM-QUATERNARY-IODIDE
Compound Number 8B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18INO
InChI InChI=1S/C13H18NO.HI/c1-3-4-7-10-14-11(2)15-13-9-6-5-8-12(13)14;/h5-6,8-9H,3-4,7,10H2,1-2H3;1H/q+1;/p-1
InChIKey YUSTVUCWDLHBRB-UHFFFAOYSA-M
Literature Reference Author A.C.PARDAL,S.S.RAMOS,P.F.SANTOS,L.V.REIS,P.ALMEIDA
Literature Reference Citation MOLECULES,7,320(2002)
Literature Reference DOI 10.3390/70300320
Molecular Weight 331.197 g/mol
Solvent CDCl3
Source File Reference UWLU7713