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omega-CHLOROTOLUENE

View entire compound with spectra: 58 NMR, 9 FTIR, 1 Raman, 15 MS (GC), and 2 Near IR

omega-CHLOROTOLUENE
SpectraBase Compound ID J6LtaAcu0NV
InChI InChI=1S/C7H7Cl/c1-6-4-2-3-5-7(6)8/h2-5H,1H3
InChIKey IBSQPLPBRSHTTG-UHFFFAOYSA-N
Mol Weight 126.59 g/mol
Molecular Formula C7H7Cl
Exact Mass 126.023628 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3WPSIXQqJuy
Name o-CHLOROTOLUENE
Source of Sample Heyden-Newport Chemical Corporation, New York, New York
Boiling Point 159.5C
CAS Registry Number 95-49-8
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H7Cl
InChI InChI=1S/C7H7Cl/c1-6-4-2-3-5-7(6)8/h2-5H,1H3
InChIKey IBSQPLPBRSHTTG-UHFFFAOYSA-N
Melting Point -36C
Molecular Weight 126.59
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms TOLUENE, O-CHLORO-,
Web Link http://www.cdc.gov/niosh/npg/npgd0135.html