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3,12-O-DIBENZOYL-LINEOLON

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3,12-O-DIBENZOYL-LINEOLON
SpectraBase Compound ID 4O7KvsIUiIW
InChI InChI=1S/C35H40O7/c1-22(36)27-16-19-35(40)33(27,3)29(42-31(38)24-12-8-5-9-13-24)21-28-32(2)17-15-26(20-25(32)14-18-34(28,35)39)41-30(37)23-10-6-4-7-11-23/h4-14,26-29,39-40H,15-21H2,1-3H3/t26-,27-,28+,29+,32-,33-,34-,35+/m0/s1
InChIKey IDAKMNKLMBDWFD-YUZZBNJASA-N
Mol Weight 572.7 g/mol
Molecular Formula C35H40O7
Exact Mass 572.277404 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JlIX5yE3Ttv
Name 3,12-O-DIBENZOYL-LINEOLON
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H40O7
InChI InChI=1S/C35H40O7/c1-22(36)27-16-19-35(40)33(27,3)29(42-31(38)24-12-8-5-9-13-24)21-28-32(2)17-15-26(20-25(32)14-18-34(28,35)39)41-30(37)23-10-6-4-7-11-23/h4-14,26-29,39-40H,15-21H2,1-3H3/t26-,27-,28+,29+,32-,33-,34-,35+/m0/s1
InChIKey IDAKMNKLMBDWFD-YUZZBNJASA-N
Literature Reference Author T.YAMAGISHI,K.HAYASHI,H.MITSUHASHI,M.IMANARI,K.MATSUSHITA
Literature Reference Citation TETRAH.LETT.,14,3527(1973)
Literature Reference DOI 10.1016/S0040-4039(01)86961-6
Molecular Weight 572.698 g/mol
Solvent CDCl3
Source File Reference UWBK1081