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2,4,5-Trijodtoluol

View entire compound with spectra: 2 NMR

2,4,5-Trijodtoluol
SpectraBase Compound ID ICNP8QBpv2S
InChI InChI=1S/C7H5I3/c1-4-2-6(9)7(10)3-5(4)8/h2-3H,1H3
InChIKey XMGWCZDUQHZUNV-UHFFFAOYSA-N
Mol Weight 469.83 g/mol
Molecular Formula C7H5I3
Exact Mass 469.752535 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GU8gTlBpfFM
Name 2,4,5-TRIJODTOLUOL
CAS Registry Number 32704-10-2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H5I3
InChI InChI=1S/C7H5I3/c1-4-2-6(9)7(10)3-5(4)8/h2-3H,1H3
InChIKey XMGWCZDUQHZUNV-UHFFFAOYSA-N
Literature Reference Author D.L.MATTERN
Literature Reference Citation J.ORG.CHEM.,49,3051(1984)
Literature Reference DOI 10.1021/jo00191a003
Molecular Weight 469.830 g/mol
Solvent CDCl3
Source File Reference UNIW12151