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(8S,9S,11R)-METHYL-8-IODO-9,11-O-ISOPROPYLIDENE-14-OXOTETRADEC-12E-EN-5-YNOATE
SpectraBase Compound ID 5YR1GDpQoLy
InChI InChI=1S/C18H25IO5/c1-18(2)23-14(9-8-12-20)13-16(24-18)15(19)10-6-4-5-7-11-17(21)22-3/h8-9,12,14-16H,5,7,10-11,13H2,1-3H3/b9-8+/t14-,15-,16-/m1/s1
InChIKey YJWDLJMRAJVOPM-NMMOIRBDSA-N
Mol Weight 448.3 g/mol
Molecular Formula C18H25IO5
Exact Mass 448.074669 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2s4N9DgskmP
Name (8S,9S,11R)-METHYL-8-IODO-9,11-O-ISOPROPYLIDENE-14-OXOTETRADEC-12E-EN-5-YNOATE
Compound Number 21
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H25IO5
InChI InChI=1S/C18H25IO5/c1-18(2)23-14(9-8-12-20)13-16(24-18)15(19)10-6-4-5-7-11-17(21)22-3/h8-9,12,14-16H,5,7,10-11,13H2,1-3H3/b9-8+/t14-,15-,16-/m1/s1
InChIKey YJWDLJMRAJVOPM-NMMOIRBDSA-N
Literature Reference Author T.DURAND,A.GUY,J.P.VIDAL,J.C.ROSSI
Literature Reference Citation J.ORG.CHEM.,67,3615(2002)
Literature Reference DOI 10.1021/jo0109624
Molecular Weight 448.298 g/mol
Solvent CDCl3
Source File Reference UWSI21777