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2(1H)-PENTALENONE, HEXAHYDRO-1,4-DIMETHYL-

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2(1H)-PENTALENONE, HEXAHYDRO-1,4-DIMETHYL-
SpectraBase Compound ID SGqCLQRJ0J
InChI InChI=1S/C10H16O/c1-6-3-4-8-7(2)10(11)5-9(6)8/h6-9H,3-5H2,1-2H3
InChIKey XRCQDEUXKSKYGE-UHFFFAOYSA-N
Mol Weight 152.24 g/mol
Molecular Formula C10H16O
Exact Mass 152.120115 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GHsbH2zTYwd
Name 2-exo, 6-exo-Dimethyl-cis-bicyclo(3.3.0)octanone-3
CAS Registry Number 63700-72-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H16O
InChI InChI=1S/C10H16O/c1-6-3-4-8-7(2)10(11)5-9(6)8/h6-9H,3-5H2,1-2H3
InChIKey XRCQDEUXKSKYGE-UHFFFAOYSA-N
Instrument Name Bruker WH-90
Literature Reference J.K. Whitesell, R.S. Matthews, J. Org. Chem. 42, 3878 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3