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1-Cyanomethyl-1H-indole-2-carboxylic acid
SpectraBase Compound ID 4wrou1h1gAi
InChI InChI=1S/C11H8N2O2/c12-5-6-13-9-4-2-1-3-8(9)7-10(13)11(14)15/h1-4,7H,6H2,(H,14,15)
InChIKey SLQUFVJVTDUONL-UHFFFAOYSA-N
Mol Weight 200.2 g/mol
Molecular Formula C11H8N2O2
Exact Mass 200.058578 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1kimpVNt1E
Name 1-Cyanomethyl-1H-indole-2-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H8N2O2
InChI InChI=1S/C11H8N2O2/c12-5-6-13-9-4-2-1-3-8(9)7-10(13)11(14)15/h1-4,7H,6H2,(H,14,15)
InChIKey SLQUFVJVTDUONL-UHFFFAOYSA-N
Molecular Weight 200.197 g/mol
SMILES OC(c1[n](c2ccccc2c1)CC#N)=O
SPLASH splash10-0006-9500000000-de18a22604ec08e8fda7
Synonyms 1-(cyanomethyl)-2-indolecarboxylic acid 1-(cyanomethyl)indole-2-carboxylic acid
Wiley ID 1440576