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Pseudocalanolide C

View entire compound with spectra: 2 NMR, and 1 MS (GC)

Pseudocalanolide C
SpectraBase Compound ID KYtW3c5AhPr
InChI InChI=1S/C22H26O5/c1-6-7-13-10-15(23)26-19-14-8-9-22(4,5)27-20(14)17-18(24)11(2)12(3)25-21(17)16(13)19/h8-12,18,24H,6-7H2,1-5H3/t11-,12+,18-/m1/s1
InChIKey XCJYGBQSIDIDLV-FTLABTOESA-N
Mol Weight 370.45 g/mol
Molecular Formula C22H26O5
Exact Mass 370.178024 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1aGO3ANSNog
Name PSEUDOCALANOLIDE-C
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H26O5
InChI InChI=1S/C22H26O5/c1-6-7-13-10-15(23)26-19-14-8-9-22(4,5)27-20(14)17-18(24)11(2)12(3)25-21(17)16(13)19/h8-12,18,24H,6-7H2,1-5H3/t11-,12+,18-/m1/s1
InChIKey XCJYGBQSIDIDLV-FTLABTOESA-N
Literature Reference Author T.C.MCKEE,J.H.DARDELLINA,G.B.DREYER,M.R.BOYD
Literature Reference Citation J.NAT.PROD.,58,916(1995)
Literature Reference DOI 10.1021/np50120a015
Molecular Weight 370.445 g/mol
Solvent CDCl3
Source File Reference UWVP4238