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(+)-(S)-2-{7-[1-(4-HYDROXYPHENYL)-ETHYL]-4-METHOXY-1-H-INDOL-3-YL}-ACETONITRILE
SpectraBase Compound ID IvPiuoAUzHW
InChI InChI=1S/C19H18N2O2/c1-12(13-3-5-15(22)6-4-13)16-7-8-17(23-2)18-14(9-10-20)11-21-19(16)18/h3-8,11-12,21-22H,9H2,1-2H3/t12-/m0/s1
InChIKey VSFGQNYRFGEQHT-LBPRGKRZSA-N
Mol Weight 306.37 g/mol
Molecular Formula C19H18N2O2
Exact Mass 306.136828 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LJ2YJGbgb4o
Name (+)-(S)-2-{7-[1-(4-HYDROXYPHENYL)-ETHYL]-4-METHOXY-1-H-INDOL-3-YL}-ACETONITRILE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H18N2O2
InChI InChI=1S/C19H18N2O2/c1-12(13-3-5-15(22)6-4-13)16-7-8-17(23-2)18-14(9-10-20)11-21-19(16)18/h3-8,11-12,21-22H,9H2,1-2H3/t12-/m0/s1
InChIKey VSFGQNYRFGEQHT-LBPRGKRZSA-N
Literature Reference Author M.CHEN,L.GAN,S.LIN,X.WANG,L.LI,Y.LI,C.ZHU,Y.WANG,B.JIANG,Y.Y ANG,J.SHI
Literature Reference Citation J.NAT.PROD.,75,1167(2012)
Literature Reference DOI 10.1021/np3002833
Molecular Weight 306.364 g/mol
Sample ID 41190
Solvent ACETONE-D6