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1-(4-CHLOROBENZOYL)-2-METHYLINDOLE-3-ACETIC-ACID
SpectraBase Compound ID IaNEqLw4TMb
InChI InChI=1S/C18H14ClNO3/c1-11-15(10-17(21)22)14-4-2-3-5-16(14)20(11)18(23)12-6-8-13(19)9-7-12/h2-9H,10H2,1H3,(H,21,22)
InChIKey QDAPWMKWLVMBBU-UHFFFAOYSA-N
Mol Weight 327.77 g/mol
Molecular Formula C18H14ClNO3
Exact Mass 327.066221 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HHAEWxcjZxG
Name 1-(4-CHLOROBENZOYL)-2-METHYLINDOLE-3-ACETIC-ACID
Compound Number 25
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H14ClNO3
InChI InChI=1S/C18H14ClNO3/c1-11-15(10-17(21)22)14-4-2-3-5-16(14)20(11)18(23)12-6-8-13(19)9-7-12/h2-9H,10H2,1H3,(H,21,22)
InChIKey QDAPWMKWLVMBBU-UHFFFAOYSA-N
Literature Reference Author A.R.MAGUIRE,S.J.PLUNKETT,S.PAPOT,M.CLYNES,R.O.CONNOR,S.TOUHE Y
Literature Reference Citation BIOORG.MED.CHEM.,9,745(2001)
Literature Reference DOI 10.1016/S0968-0896(00)00292-3
Molecular Weight 327.767 g/mol
Solvent CDCl3
Source File Reference UWLU21859