For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-METHYL-4-(1H,1H,2H,2H-PERFLUOROOCTYL)-1,2,4-TRIAZOLIUM-IODIDE
SpectraBase Compound ID 14XtfHuzSyY
InChI InChI=1S/C11H9F13N3.HI/c1-26-5-27(4-25-26)3-2-6(12,13)7(14,15)8(16,17)9(18,19)10(20,21)11(22,23)24;/h4-5H,2-3H2,1H3;1H/q+1;/p-1
InChIKey PBYKFRDIIWFUPO-UHFFFAOYSA-M
Mol Weight 557.1 g/mol
Molecular Formula C11H9F13IN3
Exact Mass 556.963358 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID GbiRvRsNSo
Name 1-METHYL-4-(1H,1H,2H,2H-PERFLUOROOCTYL)-1,2,4-TRIAZOLIUM-IODIDE
Compound Number 4H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H9F13IN3
InChI InChI=1S/C11H9F13N3.HI/c1-26-5-27(4-25-26)3-2-6(12,13)7(14,15)8(16,17)9(18,19)10(20,21)11(22,23)24;/h4-5H,2-3H2,1H3;1H/q+1;/p-1
InChIKey PBYKFRDIIWFUPO-UHFFFAOYSA-M
Literature Reference Author Y.R.MIRZAEI,B.TWAMLEY,J.M.SHREEVE
Literature Reference Citation J.ORG.CHEM.,67,9340(2002)
Literature Reference DOI 10.1021/jo026350g
Solvent ACETONE-D6
Source File Reference UWMS25344