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METHYL-(1S,3S)-2,2-[(1'R,2'R)-CYCLOHEPTANE-1',2'-DIOXY]-3-IODO-1-NONYLCYCLOPENTANECARBOXYLATE
SpectraBase Compound ID AqOhClADubr
InChI InChI=1S/C23H39IO4/c1-3-4-5-6-7-8-12-16-22(21(25)26-2)17-15-20(24)23(22)27-18-13-10-9-11-14-19(18)28-23/h18-20H,3-17H2,1-2H3/t18-,19-,20+,22-/m1/s1
InChIKey OLMOZWNAOIVACH-XWSHUIEDSA-N
Mol Weight 506.5 g/mol
Molecular Formula C23H39IO4
Exact Mass 506.189305 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DPiiYsngQN4
Name METHYL-(1S,3S)-2,2-[(1'R,2'R)-CYCLOHEPTANE-1',2'-DIOXY]-3-IODO-1-NONYLCYCLOPENTANECARBOXYLATE
Compound Number 10 B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H39IO4
InChI InChI=1S/C23H39IO4/c1-3-4-5-6-7-8-12-16-22(21(25)26-2)17-15-20(24)23(22)27-18-13-10-9-11-14-19(18)28-23/h18-20H,3-17H2,1-2H3/t18-,19-,20+,22-/m1/s1
InChIKey OLMOZWNAOIVACH-XWSHUIEDSA-N
Literature Reference Author K.KATO,H.SUZUKI,H.TANAKA,T.MIYASAKA,M.BABA,K.YAMAGUCHI,H.AKI TA
Literature Reference Citation CHEM.PHARM.BULL.,47,1256(1999)
Literature Reference DOI 10.1248/cpb.47.1256
Molecular Weight 506.465 g/mol
Solvent CDCl3
Source File Reference UWLU8225