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3-Iodotoluene

View entire compound with spectra: 11 NMR, 8 FTIR, 1 Raman, and 5 MS (GC)

3-Iodotoluene
SpectraBase Compound ID yapdHc9hou
InChI InChI=1S/C7H7I/c1-6-3-2-4-7(8)5-6/h2-5H,1H3
InChIKey VLCPISYURGTGLP-UHFFFAOYSA-N
Mol Weight 218.04 g/mol
Molecular Formula C7H7I
Exact Mass 217.959245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CAJy2uryqHP
Name 3-JODTOLUOL
CAS Registry Number 625-95-6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H7I
InChI InChI=1S/C7H7I/c1-6-3-2-4-7(8)5-6/h2-5H,1H3
InChIKey VLCPISYURGTGLP-UHFFFAOYSA-N
Literature Reference Author W.F.BAILEY,E.A.CIOFFI,K.B.WIBERG
Literature Reference Citation J.ORG.CHEM.,46,4219(1981)
Literature Reference DOI 10.1021/jo00334a023
Molecular Weight 218.037 g/mol
Solvent CDCl3
Source File Reference UNIW20110