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3-(DODECANOYLOXY)-2-(ISOBUTYRYLOXY)-4-METHYL-PENTANOIC-ACID
SpectraBase Compound ID E2dE0VZRXWQ
InChI InChI=1S/C22H40O6/c1-6-7-8-9-10-11-12-13-14-15-18(23)27-19(16(2)3)20(21(24)25)28-22(26)17(4)5/h16-17,19-20H,6-15H2,1-5H3,(H,24,25)
InChIKey FLVBOVQKMCPBFE-UHFFFAOYSA-N
Mol Weight 400.6 g/mol
Molecular Formula C22H40O6
Exact Mass 400.282489 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CR8uaZHEtUX
Name 3-(DODECANOYLOXY)-2-(ISOBUTYRYLOXY)-4-METHYL-PENTANOIC-ACID
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H40O6
InChI InChI=1S/C22H40O6/c1-6-7-8-9-10-11-12-13-14-15-18(23)27-19(16(2)3)20(21(24)25)28-22(26)17(4)5/h16-17,19-20H,6-15H2,1-5H3,(H,24,25)
InChIKey FLVBOVQKMCPBFE-UHFFFAOYSA-N
Literature Reference Author Y.S.KIM,H.KIM,E.JUANG,W.HWANG,E.J.KANG,S.LEE,B.J.HA,J.LEE,D. PARK
Literature Reference Citation MOLECULES,17,12469(2012)
Literature Reference DOI 10.3390/molecules171112469
Molecular Weight 400.556 g/mol
Sample ID 1528
Solvent CD3OD