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6-METHYL-9-PARA-TOLYL-10,11-DIOXATRICYCLO-[6.2.1.0(1,6)]-UNDECAN-7-ONE
SpectraBase Compound ID 3iHHbAqf4KL
InChI InChI=1S/C17H20O3/c1-11-5-7-12(8-6-11)13-14-15(18)16(2)9-3-4-10-17(16,19-13)20-14/h5-8,13-14H,3-4,9-10H2,1-2H3/t13-,14+,16+,17+/m0/s1
InChIKey FCSHUSKZGKSJLU-XOSAIJSUSA-N
Mol Weight 272.34 g/mol
Molecular Formula C17H20O3
Exact Mass 272.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8lwvqHYCl1p
Name 6-METHYL-9-PARA-TOLYL-10,11-DIOXATRICYCLO-[6.2.1.0(1,6)]-UNDECAN-7-ONE
Compound Number 16A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H20O3
InChI InChI=1S/C17H20O3/c1-11-5-7-12(8-6-11)13-14-15(18)16(2)9-3-4-10-17(16,19-13)20-14/h5-8,13-14H,3-4,9-10H2,1-2H3/t13-,14+,16+,17+/m0/s1
InChIKey FCSHUSKZGKSJLU-XOSAIJSUSA-N
Literature Reference Author S.MUTHUSAMI,S.A.BABU,C.GUNANATHAN,B.GANGULY,E.SURESH,P.DASTI DAR
Literature Reference Citation J.ORG.CHEM.,67,8019(2002)
Literature Reference DOI 10.1021/jo0256134
Molecular Weight 272.344 g/mol
Solvent CDCl3
Source File Reference UWMS23790