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Toluene

View entire compound with spectra: 134 NMR, 16 FTIR, 4 Raman, 41 MS (GC), and 2 Near IR

Toluene
SpectraBase Compound ID BuMrYXxCSAr
InChI InChI=1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3
InChIKey YXFVVABEGXRONW-UHFFFAOYSA-N
Mol Weight 92.14 g/mol
Molecular Formula C7H8
Exact Mass 92.0626 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AAQ9uoYvxWK
Name TOLUENE
Source of Sample U.S. Testing Company, Inc., Hoboken, New Jersey
Boiling Point 111C
CAS Registry Number 108-88-3
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H8
InChI InChI=1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3
InChIKey YXFVVABEGXRONW-UHFFFAOYSA-N
Melting Point -93C
Molecular Weight 92.14
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian HA-100/Digilab FT-NMR-3
Synonyms BENZENE, METHYL-,
Web Link http://www.cdc.gov/niosh/npg/npgd0619.html