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(8S,9S,11R)-METHYL-8-IODO-9,11-O-ISOPROPYLIDENE-12-OXODODEC-5-YNOATE
SpectraBase Compound ID Jc4tNZRSNzm
InChI InChI=1S/C16H23IO5/c1-16(2)21-12(11-18)10-14(22-16)13(17)8-6-4-5-7-9-15(19)20-3/h11-14H,5,7-10H2,1-3H3/t12-,13+,14+/m0/s1
InChIKey ZJINSNPCIIHGTL-BFHYXJOUSA-N
Mol Weight 422.26 g/mol
Molecular Formula C16H23IO5
Exact Mass 422.059019 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KUi5KG35PUT
Name (8S,9S,11R)-METHYL-8-IODO-9,11-O-ISOPROPYLIDENE-12-OXODODEC-5-YNOATE
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H23IO5
InChI InChI=1S/C16H23IO5/c1-16(2)21-12(11-18)10-14(22-16)13(17)8-6-4-5-7-9-15(19)20-3/h11-14H,5,7-10H2,1-3H3/t12-,13+,14+/m0/s1
InChIKey ZJINSNPCIIHGTL-BFHYXJOUSA-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 422.260 g/mol
Solvent CDCl3
Source File Reference UWSI21776