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(1S*,3R*,7R*,9S*,15R*)-7-METHYL-3-PENTYL-2,8,11,14-TETRAOXATETRACYCLO-[9.5.0.0(10,12)0(9,15)]-HEXADECAN-13-ONE
SpectraBase Compound ID CKjptX7q551
InChI InChI=1S/C18H28O5/c1-3-4-5-7-11-8-6-9-18(2)13(20-11)10-12-14(23-18)15-16(22-15)17(19)21-12/h11-16H,3-10H2,1-2H3/t11-,12-,13+,14-,15-,16-,18-/m1/s1
InChIKey WKZBMNJBZFCVCZ-GZIOAMKESA-N
Mol Weight 324.42 g/mol
Molecular Formula C18H28O5
Exact Mass 324.193674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5f1W7ISzBzq
Name (1S*,3R*,7R*,9S*,15R*)-7-METHYL-3-PENTYL-2,8,11,14-TETRAOXATETRACYCLO-[9.5.0.0(10,12)0(9,15)]-HEXADECAN-13-ONE
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H28O5
InChI InChI=1S/C18H28O5/c1-3-4-5-7-11-8-6-9-18(2)13(20-11)10-12-14(23-18)15-16(22-15)17(19)21-12/h11-16H,3-10H2,1-2H3/t11-,12-,13+,14-,15-,16-,18-/m1/s1
InChIKey WKZBMNJBZFCVCZ-GZIOAMKESA-N
Literature Reference Author C.CRAWFORD,A.NELSON,I.PATEL
Literature Reference Citation ORG.LETTERS,8,4231(2006)
Literature Reference DOI 10.1021/ol0614323
Molecular Weight 324.417 g/mol
Sample ID 61461
Solvent CDCl3