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2-METHOXY-12-METHYLOCTADECA-17-ENE-5-YNOIC-ANHYDRIDE
SpectraBase Compound ID 6pEIbPj89UX
InChI InChI=1S/C40H66O5/c1-7-9-11-23-29-35(3)31-25-19-15-13-17-21-27-33-37(43-5)39(41)45-40(42)38(44-6)34-28-22-18-14-16-20-26-32-36(4)30-24-12-10-8-2/h7-8,35-38H,1-2,9-16,19-20,23-34H2,3-6H3
InChIKey VOGBKCAANIAXCI-UHFFFAOYSA-N
Mol Weight 627.0 g/mol
Molecular Formula C40H66O5
Exact Mass 626.491025 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8OtKZdizzIM
Name 2-METHOXY-12-METHYLOCTADECA-17-ENE-5-YNOIC-ANHYDRIDE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H66O5
InChI InChI=1S/C40H66O5/c1-7-9-11-23-29-35(3)31-25-19-15-13-17-21-27-33-37(43-5)39(41)45-40(42)38(44-6)34-28-22-18-14-16-20-26-32-36(4)30-24-12-10-8-2/h7-8,35-38H,1-2,9-16,19-20,23-34H2,3-6H3
InChIKey VOGBKCAANIAXCI-UHFFFAOYSA-N
Literature Reference Author H.S.LEE,J.R.RHO,C.J.SIM,J.SHIN
Literature Reference Citation J.NAT.PROD.,66,566(2003)
Literature Reference DOI 10.1021/np020345q
Molecular Weight 626.961 g/mol
Solvent CDCl3
Source File Reference UWSI7654