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2-[E-(PROP-1-EN-1-YL)]-4-PHENOXYPHENOXY-ETHANOL
SpectraBase Compound ID 2epcQ87cjvK
InChI InChI=1S/C17H18O3/c1-2-6-14-13-16(9-10-17(14)19-12-11-18)20-15-7-4-3-5-8-15/h2-10,13,18H,11-12H2,1H3/b6-2+
InChIKey WGMNELSRPBLBPU-QHHAFSJGSA-N
Mol Weight 270.33 g/mol
Molecular Formula C17H18O3
Exact Mass 270.125594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2oHCIoCXtxD
Name 2-[E-(PROP-1-EN-1-YL)]-4-PHENOXYPHENOXY-ETHANOL
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H18O3
InChI InChI=1S/C17H18O3/c1-2-6-14-13-16(9-10-17(14)19-12-11-18)20-15-7-4-3-5-8-15/h2-10,13,18H,11-12H2,1H3/b6-2+
InChIKey WGMNELSRPBLBPU-QHHAFSJGSA-N
Literature Reference Author E.ELHALEM,B.N.BAILEY,R.DOCAMPO,I.UJVARY,S.H.SZAJNMAN,J.B.ROD RIGUEZ
Literature Reference Citation J.MED.CHEM.,45,3984(2002)
Literature Reference DOI 10.1021/jm0201518
Molecular Weight 270.328 g/mol
Sample ID 64979
Solvent CDCl3