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TETRACYCLO-[3.2.0.0(2,7).0(4,6)]-HEPTAN-3-ON,(QUADRICYCLANON)
SpectraBase Compound ID CMqGgDtR3Z3
InChI InChI=1S/C7H6O/c8-7-5-1-2(5)4-3(1)6(4)7/h1-6H/t1-,2+,3-,4+,5+,6-
InChIKey BYUGRALWTPEHMX-XBQGMCBBSA-N
Mol Weight 106.12 g/mol
Molecular Formula C7H6O
Exact Mass 106.041865 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5PkO66lq1QX
Name Tetracyclo(3.2.0.0/2,7/.0/4,6/)heptan-3-one
CAS Registry Number 1072-92-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H6O
InChI InChI=1S/C7H6O/c8-7-5-1-2(5)4-3(1)6(4)7/h1-6H/t1-,2+,3-,4+,5+,6-
InChIKey BYUGRALWTPEHMX-XBQGMCBBSA-N
Instrument Name Varian XL-100
Literature Reference L. Knothe, J. Werp, Liebigs Ann. Chem. 709 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3