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trans-3,3a,4,5,6,6a-HEXAHYDRO-5-HYDROXY-2(1H)-PENTALENONE
SpectraBase Compound ID 77jnF5oi4r0
InChI InChI=1S/C8H12O2/c9-7-1-5-2-8(10)4-6(5)3-7/h5-7,9H,1-4H2
InChIKey PQWWWWBPUGFVIZ-UHFFFAOYSA-N
Mol Weight 140.18 g/mol
Molecular Formula C8H12O2
Exact Mass 140.08373 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7o2C0UT3tMk
Name trans-7-Hydroxy-bicyclo(3.3.0)octan-3-one
CAS Registry Number 83998-85-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H12O2
InChI InChI=1S/C8H12O2/c9-7-1-5-2-8(10)4-6(5)3-7/h5-7,9H,1-4H2
InChIKey PQWWWWBPUGFVIZ-UHFFFAOYSA-N
Literature Reference P.H. Schippers, H.P. Dekkers, J. Am. Chem. Soc. 105, 145 (1983).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3