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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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4H9K7glLvzm
Name Benzene, 1-iodo-3-methyl-
CAS Registry Number 625-95-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. 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
Molecular Weight 218.037 g/mol
SMILES Cc1cc(I)ccc1
SPLASH splash10-014i-8090000000-4bdf12fdc1406ed4fcd5
Source of Spectrum AA-0-1546-3
Synonyms 1-Iodanyl-3-methyl-benzene m-Iodotoluene 1-Iodo-3-methyl-benzene 3-Iodotoluene 3-Methylphenyl iodide m-Methyliodobenzene M-tolyl iodide Toluene, m-iodo- 1-Iodo-3-methylbenzene BRN 1903634 EINECS 210-918-5 NSC 3775
Wiley ID 27713