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1-Methyl-4-(3,3,3-trifluoropropyl)-1,2,4-triazolium Iodide
SpectraBase Compound ID 2ZwE5G3S7Xx
InChI InChI=1S/C6H9F3N3.HI/c1-11-5-12(4-10-11)3-2-6(7,8)9;/h4-5H,2-3H2,1H3;1H/q+1;/p-1
InChIKey DQLKURXZSJUTKA-UHFFFAOYSA-M
Mol Weight 307.06 g/mol
Molecular Formula C6H9F3IN3
Exact Mass 306.979327 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1hLP0jbvbbQ
Name 1-METHYL-4-(3,3,3-TRIFLUOROPROPYL)-1,2,4-TRIAZOLIUM-IODIDE
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H9F3IN3
InChI InChI=1S/C6H9F3N3.HI/c1-11-5-12(4-10-11)3-2-6(7,8)9;/h4-5H,2-3H2,1H3;1H/q+1;/p-1
InChIKey DQLKURXZSJUTKA-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 UWMS25342