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(E)-Isoelemicin

View entire compound with spectra: 3 NMR, and 8 MS (GC)

(E)-Isoelemicin
SpectraBase Compound ID 3BH7HLlnMCH
InChI InChI=1S/C12H16O3/c1-5-6-9-7-10(13-2)12(15-4)11(8-9)14-3/h5-8H,1-4H3/b6-5+
InChIKey RRXOQHQFJOQLQR-AATRIKPKSA-N
Mol Weight 208.26 g/mol
Molecular Formula C12H16O3
Exact Mass 208.109944 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GrxxCiI452Y
Name (E)-ISOELEMICIN
Compound Number 30
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H16O3
InChI InChI=1S/C12H16O3/c1-5-6-9-7-10(13-2)12(15-4)11(8-9)14-3/h5-8H,1-4H3/b6-5+
InChIKey RRXOQHQFJOQLQR-AATRIKPKSA-N
Literature Reference Author H.ACHENBACH,D.FREY
Literature Reference Citation PHYTOCHEM.,31,4263(1992)
Literature Reference DOI 10.1016/0031-9422(92)80456-O
Molecular Weight 208.257 g/mol
Solvent CDCl3
Source File Reference UWVN26731