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Cyclooctatetraene

View entire compound with spectra: 34 NMR, 4 FTIR, 1 Raman, 6 MS (GC), and 2 Near IR

Cyclooctatetraene
SpectraBase Compound ID 2JRgk7qA60q
InChI InChI=1S/C8H8/c1-2-4-6-8-7-5-3-1/h1-8H/b2-1-,3-1-,4-2-,5-3-,6-4-,7-5-,8-6-,8-7-
InChIKey KDUIUFJBNGTBMD-BONZMOEMSA-N
Mol Weight 104.15 g/mol
Molecular Formula C8H8
Exact Mass 104.0626 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Zg1w9Dj0zA
Name 1,3,5,7-CYCLOOCTATETRAENE
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
Boiling Point 142-143C
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8
InChI InChI=1S/C8H8/c1-2-4-6-8-7-5-3-1/h1-8H/b2-1-,3-1-,4-2-,5-3-,6-4-,7-5-,8-6-,8-7-
InChIKey KDUIUFJBNGTBMD-BONZMOEMSA-N
Melting Point -27C
Molecular Weight 104.15
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms CYCLOOCTATETRAENE, 1,3,5,7-,