John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=2km1UkyRaVA SpectraBase Spectrum ID=Ak5mVicfCiT

(accessed ).
4'-[3-(4-HYDROXYCYClOHEXYL)-PROPIONYL]-SYRINGOLIDE-1
SpectraBase Compound ID 2km1UkyRaVA
InChI InChI=1S/C22H34O8/c1-2-3-4-11-22(26)18-20(25)27-13-21(18)19(30-22)16(12-28-21)29-17(24)10-7-14-5-8-15(23)9-6-14/h14-16,18-19,23,26H,2-13H2,1H3/t14?,15?,16-,18+,19+,21+,22-/m0/s1
InChIKey BSHITOATBHUAJE-FQCTYETISA-N
Mol Weight 426.5 g/mol
Molecular Formula C22H34O8
Exact Mass 426.225368 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ak5mVicfCiT
Name 4'-[3-(4-HYDROXYCYClOHEXYL)-PROPIONYL]-SYRINGOLIDE-1
Compound Number 3D
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H34O8
InChI InChI=1S/C22H34O8/c1-2-3-4-11-22(26)18-20(25)27-13-21(18)19(30-22)16(12-28-21)29-17(24)10-7-14-5-8-15(23)9-6-14/h14-16,18-19,23,26H,2-13H2,1H3/t14?,15?,16-,18+,19+,21+,22-/m0/s1
InChIKey BSHITOATBHUAJE-FQCTYETISA-N
Literature Reference Author T.TSURUSHIMA,S.L.MIDLAND,C.M.ZENG,C.JI,J.J.SIMS,N.T.KEEN
Literature Reference Citation PHYTOCHEM.,43,1219(1996)
Literature Reference DOI 10.1016/S0031-9422(96)00530-4
Molecular Weight 426.507 g/mol
Solvent CDCl3
Source File Reference UWMS2367
SpectraBase Batch ID 28zpANZvHiM