John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=AnxAB9VCnRY SpectraBase Spectrum ID=1j3YSsABx8E

(accessed ).
1-DECYL-4-(1H,1H,2H,2H-PERFLUOROHEXYL)-1,2,4-TRIAZOLIUM-IODIDE
SpectraBase Compound ID AnxAB9VCnRY
InChI InChI=1S/C18H27F9N3.HI/c1-2-3-4-5-6-7-8-9-11-30-14-29(13-28-30)12-10-15(19,20)16(21,22)17(23,24)18(25,26)27;/h13-14H,2-12H2,1H3;1H/q+1;/p-1
InChIKey SAFHRCXPAYKYBD-UHFFFAOYSA-M
Mol Weight 583.33 g/mol
Molecular Formula C18H27F9IN3
Exact Mass 583.110604 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1j3YSsABx8E
Name 1-DECYL-4-(1H,1H,2H,2H-PERFLUOROHEXYL)-1,2,4-TRIAZOLIUM-IODIDE
Compound Number 4G
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H27F9IN3
InChI InChI=1S/C18H27F9N3.HI/c1-2-3-4-5-6-7-8-9-11-30-14-29(13-28-30)12-10-15(19,20)16(21,22)17(23,24)18(25,26)27;/h13-14H,2-12H2,1H3;1H/q+1;/p-1
InChIKey SAFHRCXPAYKYBD-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 UWMS25343
SpectraBase Batch ID CSxXHem00qo