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5-(2-ACETOXY-8-OXOTRIDECYL)-RESORCINOL

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

5-(2-ACETOXY-8-OXOTRIDECYL)-RESORCINOL
SpectraBase Compound ID CDWfSvr8Icz
InChI InChI=1S/C21H32O5/c1-3-4-6-9-18(23)10-7-5-8-11-21(26-16(2)22)14-17-12-19(24)15-20(25)13-17/h12-13,15,21,24-25H,3-11,14H2,1-2H3
InChIKey NKOQQNIPHFLJDL-UHFFFAOYSA-N
Mol Weight 364.5 g/mol
Molecular Formula C21H32O5
Exact Mass 364.224974 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 60ZxLrf2tNT
Name 5-(2-ACETOXY-8-OXOTRIDECYL)-RESORCINOL
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H32O5
InChI InChI=1S/C21H32O5/c1-3-4-6-9-18(23)10-7-5-8-11-21(26-16(2)22)14-17-12-19(24)15-20(25)13-17/h12-13,15,21,24-25H,3-11,14H2,1-2H3
InChIKey NKOQQNIPHFLJDL-UHFFFAOYSA-N
Literature Reference Author L.M.CANEDO,J.M.M.D.CORRAL,A.S.FELICIANO
Literature Reference Citation PHYTOCHEM.,44,1559(1997)
Literature Reference DOI 10.1016/S0031-9422(96)00755-8
Molecular Weight 364.482 g/mol
Solvent CDCl3
Source File Reference UWAN123