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 3-Aminopropionitrile
5 spectra     
 C3H6N2  Generated by the Chemistry Development Kit (http://github.com/cdk) \n  70.05310   
  
   
 3-Ethoxybenzoic acid
5 spectra     
 C9H10O3  Generated by the Chemistry Development Kit (http://github.com/cdk) \n  166.06299   
  
   
 3-Fluorobenzoic acid
5 spectra     
 C7H5FO2  Generated by the Chemistry Development Kit (http://github.com/cdk) \n  140.02736   
  
   
 3-Hydroxy-3-methylglutaric acid
5 spectra     
 C6H10O5  Generated by the Chemistry Development Kit (http://github.com/cdk) \n  162.05283   
  
   
 3-Hydroxy-DL-kynurenine
11 spectra     
 C10H12N2O4  Generated by the Chemistry Development Kit (http://github.com/cdk) \n  224.07971   
  
   
 3-Indoleacetonitrile
10 spectra     
 C10H8N2  Generated by the Chemistry Development Kit (http://github.com/cdk) \n  156.06876   
  
   
 3-Indolebutyric acid
10 spectra     
 C12H13NO2  Generated by the Chemistry Development Kit (http://github.com/cdk) \n  203.09464   
  
   
 3-Indoxyl sulfate
5 spectra     
 C8H7NO4S  Generated by the Chemistry Development Kit (http://github.com/cdk) \n  213.00958   
  
   
 3-Iodotyrosine
18 spectra     
 C9H10INO3  Generated by the Chemistry Development Kit (http://github.com/cdk) \n  306.97055   
  
   
 3-Methyladenine
5 spectra     
 C6H7N5  Generated by the Chemistry Development Kit (http://github.com/cdk) \n  149.07014   
  
   
 3-Methylbenzoic acid
4 spectra     
 C8H8O2  Generated by the Chemistry Development Kit (http://github.com/cdk) \n  136.05243   
  
   
 3-Methylguanine
10 spectra     
 C6H7N5O  Generated by the Chemistry Development Kit (http://github.com/cdk) \n  165.06506   
  
   
 3-Phenylpropionic acid
4 spectra     
 C9H10O2  Generated by the Chemistry Development Kit (http://github.com/cdk) \n  150.06808   
  
   
 3-Phosphoglycerate
4 spectra     
 C3H7O7P  Generated by the Chemistry Development Kit (http://github.com/cdk) \n  185.99294   
  
   
 4,4'-Methylene bis(o-chloroaniline)
6 spectra     
 C13H12Cl2N2  Generated by the Chemistry Development Kit (http://github.com/cdk) \n  266.03775   
  
   
 4-Acetylbutyric acid
5 spectra     
 C6H10O3  Generated by the Chemistry Development Kit (http://github.com/cdk) \n  130.06299   
  
   
 4-Aminobenzoic acid
10 spectra     
 C7H7NO2  Generated by the Chemistry Development Kit (http://github.com/cdk) \n  137.04768   
  
   
 4-Aminoindole
5 spectra     
 C8H8N2  Generated by the Chemistry Development Kit (http://github.com/cdk) \n  132.06876   
  
   
 4-Aminosalicylic acid
5 spectra     
 C7H7NO3  Generated by the Chemistry Development Kit (http://github.com/cdk) \n  153.04259   
  
   
 4-Chlorobenzoic acid
5 spectra     
 C7H5ClO2  Generated by the Chemistry Development Kit (http://github.com/cdk) \n  155.99780   
  
   
 4-Coumaric acid
5 spectra     
 C9H8O3  Generated by the Chemistry Development Kit (http://github.com/cdk) \n  164.04733   
  
   
 4-CPA
5 spectra     
 C8H7ClO3  Generated by the Chemistry Development Kit (http://github.com/cdk) \n  186.00838   
  
   
 4-Fluoroaniline
5 spectra     
 C6H6FN  Generated by the Chemistry Development Kit (http://github.com/cdk) \n  111.04843   
  
   
 4-Fluorobenzoic acid
5 spectra     
 C7H5FO2  Generated by the Chemistry Development Kit (http://github.com/cdk) \n  140.02736   
  
   
 4-Hydroxy-3-methoxybenzoic acid
5 spectra     
 C8H8O4  Generated by the Chemistry Development Kit (http://github.com/cdk) \n  168.04227   
         
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