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Benzene

View entire compound with spectra: 317 NMR, 12 FTIR, 2 Raman, 38 MS (GC), and 2 Near IR

Benzene
SpectraBase Compound ID IG4vKOtLCxH
InChI InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H
InChIKey UHOVQNZJYSORNB-UHFFFAOYSA-N
Mol Weight 78.11 g/mol
Molecular Formula C6H6
Exact Mass 78.04695 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LfQLatpus92
Name Benzene
CAS Registry Number 71-43-2
Comments J(C,C) AND J(C,H) FROM 2ND REFERENCE H.J.JAKOBSEN,T.LUND,UNPUBLISHED(1979
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H6
InChI InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H
InChIKey UHOVQNZJYSORNB-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference G.C. Levy, J.D. Cargioli, J. Magn. Resonance 6, 143 (1972).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3