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NAKIJIQUINONE-S
SpectraBase Compound ID J5j5gECUX53
InChI InChI=1S/C25H36O4/c1-6-7-13-29-20-14-19(26)22(27)18(23(20)28)15-25(5)17(3)11-12-24(4)16(2)9-8-10-21(24)25/h9,14,17,21,27H,6-8,10-13,15H2,1-5H3/t17-,21+,24+,25+/m0/s1
InChIKey XGHYSICSWSEAKO-CMEURUHUSA-N
Mol Weight 400.6 g/mol
Molecular Formula C25H36O4
Exact Mass 400.26136 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E3UyPdf5CZC
Name NAKIJIQUINONE-S
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H36O4
InChI InChI=1S/C25H36O4/c1-6-7-13-29-20-14-19(26)22(27)18(23(20)28)15-25(5)17(3)11-12-24(4)16(2)9-8-10-21(24)25/h9,14,17,21,27H,6-8,10-13,15H2,1-5H3/t17-,21+,24+,25+/m0/s1
InChIKey XGHYSICSWSEAKO-CMEURUHUSA-N
Literature Reference Author H.SUZUKI,T.KUBOTA,A.TAKAHASHI-NAKAGUCHI,J.FROMONT,T.GONOI,J. KOBAYASHI
Literature Reference Citation CHEM.PHARM.BULL.,62,209(2014)
Literature Reference DOI 10.1248/cpb.c13-00810
Molecular Weight 400.558 g/mol
Solvent DMSO-D6
Source File Reference UWBT13829