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N-HEXYL-2-METHYLBENZOTHIAZOLIUM-QUATERNARY-IODIDE
SpectraBase Compound ID 96ZqbG0pRuW
InChI InChI=1S/C14H20NS.HI/c1-3-4-5-8-11-15-12(2)16-14-10-7-6-9-13(14)15;/h6-7,9-10H,3-5,8,11H2,1-2H3;1H/q+1;/p-1
InChIKey XLLPCAOZQBPGMH-UHFFFAOYSA-M
Mol Weight 361.29 g/mol
Molecular Formula C14H20INS
Exact Mass 361.036116 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6774fYOUciN
Name N-HEXYL-2-METHYLBENZOTHIAZOLIUM-QUATERNARY-IODIDE
Compound Number 6C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H20INS
InChI InChI=1S/C14H20NS.HI/c1-3-4-5-8-11-15-12(2)16-14-10-7-6-9-13(14)15;/h6-7,9-10H,3-5,8,11H2,1-2H3;1H/q+1;/p-1
InChIKey XLLPCAOZQBPGMH-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 361.284 g/mol
Solvent DMSO-D6
Source File Reference UWLU7708