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PESTALOTHEOL-E

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

PESTALOTHEOL-E
SpectraBase Compound ID 3CkV8NXFsJD
InChI InChI=1S/C16H24O5/c1-15(2)7-9(17)12-10(21-15)5-8-6-11(16(3,4)19)20-14(8)13(12)18/h8,11,13-14,18-19H,5-7H2,1-4H3/t8-,11-,13+,14-/m1/s1
InChIKey DZAJOXRUACGTEM-DQBQHTNRSA-N
Mol Weight 296.36 g/mol
Molecular Formula C16H24O5
Exact Mass 296.162374 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BK5MglhLna7
Name PESTALOTHEOL-E
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H24O5
InChI InChI=1S/C16H24O5/c1-15(2)7-9(17)12-10(21-15)5-8-6-11(16(3,4)19)20-14(8)13(12)18/h8,11,13-14,18-19H,5-7H2,1-4H3/t8-,11-,13+,14-/m1/s1
InChIKey DZAJOXRUACGTEM-DQBQHTNRSA-N
Literature Reference Author S.QIN,K.KROHN,H.HUSSAIN,B.SCHULZ,S.DRAEGER
Literature Reference Citation EUR.J.ORG.CHEM.,2011,5163(2011)
Literature Reference DOI 10.1002/ejoc.201100568
Molecular Weight 296.364 g/mol
Solvent CDCl3
Source File Reference UWBT21205