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1-[2-(2-Aminophenyl)-2-oxoethyl]-1H-prrrole-2-carbaldehyde
SpectraBase Compound ID 80CuCfg6U3l
InChI InChI=1S/C13H12N2O2/c14-12-6-2-1-5-11(12)13(17)8-15-7-3-4-10(15)9-16/h1-7,9H,8,14H2
InChIKey FJWKXNDABJESEM-UHFFFAOYSA-N
Mol Weight 228.25 g/mol
Molecular Formula C13H12N2O2
Exact Mass 228.089878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 375qIpcLUe
Name 1-[2-(2-Aminophenyl)-2-oxoethyl]-1H-prrrole-2-carbaldehyde
Appearance Colourless microcrystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12N2O2
InChI InChI=1S/C13H12N2O2/c14-12-6-2-1-5-11(12)13(17)8-15-7-3-4-10(15)9-16/h1-7,9H,8,14H2
InChIKey FJWKXNDABJESEM-UHFFFAOYSA-N
Instrument Name JEOL JMS-AX 505W/Bruker Apex III
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0009.214
Molecular Weight 228.251 g/mol
Reported Formula C13H12N2O2
SMILES Nc1ccccc1C(C[n]1c(ccc1)C=O)=O
SPLASH splash10-010u-7940000000-e51f5e4d5fdbadad3910
Source of Spectrum ARK-2008-129-3a
Wiley ID 1869419