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6-PENTYL-4-METHYL-CYCLOHEPT-4-EN-1,3-DIONE

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6-PENTYL-4-METHYL-CYCLOHEPT-4-EN-1,3-DIONE
SpectraBase Compound ID 8Y251xxszfE
InChI InChI=1S/C13H20O2/c1-3-4-5-6-11-8-13(15)9-12(14)7-10(11)2/h7,11H,3-6,8-9H2,1-2H3
InChIKey CORBKXCAQQMQJY-UHFFFAOYSA-N
Mol Weight 208.3 g/mol
Molecular Formula C13H20O2
Exact Mass 208.14633 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H3gv04aun9C
Name 6-PENTYL-4-METHYL-CYCLOHEPT-4-EN-1,3-DIONE
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H20O2
InChI InChI=1S/C13H20O2/c1-3-4-5-6-11-8-13(15)9-12(14)7-10(11)2/h7,11H,3-6,8-9H2,1-2H3
InChIKey CORBKXCAQQMQJY-UHFFFAOYSA-N
Literature Reference Author K.TAKEDA,Y.OHTANI
Literature Reference Citation ORG.LETTERS,1,677(1999)
Literature Reference DOI 10.1021/ol990764n
Molecular Weight 208.301 g/mol
Solvent CDCl3
Source File Reference UWSI26171