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4'-(2(S)-Methoxy-propoxy)-phenyl 4-undecyloxy-benzoate

View entire compound with spectra: 1 NMR

4'-(2(S)-Methoxy-propoxy)-phenyl 4-undecyloxy-benzoate
SpectraBase Compound ID HGx4HenLuP0
InChI InChI=1S/C28H40O5/c1-4-5-6-7-8-9-10-11-12-21-31-25-15-13-24(14-16-25)28(29)33-27-19-17-26(18-20-27)32-22-23(2)30-3/h13-20,23H,4-12,21-22H2,1-3H3
InChIKey ATHPWLCSALSFAM-UHFFFAOYSA-N
Mol Weight 456.6 g/mol
Molecular Formula C28H40O5
Exact Mass 456.287574 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KxtwBAU2ycn
Name 4'-(2(S)-Methoxy-propoxy)-phenyl 4-undecyloxy-benzoate
CAS Registry Number 103239-91-4
Comments reassigned
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C28H40O5
InChI InChI=1S/C28H40O5/c1-4-5-6-7-8-9-10-11-12-21-31-25-15-13-24(14-16-25)28(29)33-27-19-17-26(18-20-27)32-22-23(2)30-3/h13-20,23H,4-12,21-22H2,1-3H3
InChIKey ATHPWLCSALSFAM-UHFFFAOYSA-N
Instrument Name Bruker WM-250
Literature Reference D.M. Walba, S.C. Slater, W.N. Thurmes, J. Am. Chem. Soc. 108, 5210 (1986).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3