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3-[[N-(Phenylpropargyl)amino]glyoxylyl]indole-2-acetic Acid
SpectraBase Compound ID JUXhjkJj722
InChI InChI=1S/C21H16N2O4/c24-18(25)13-17-19(15-10-4-5-11-16(15)23-17)20(26)21(27)22-12-6-9-14-7-2-1-3-8-14/h1-5,7-8,10-11,23H,12-13H2,(H,22,27)(H,24,25)
InChIKey GJVKAZPNWLJYCH-UHFFFAOYSA-N
Mol Weight 360.37 g/mol
Molecular Formula C21H16N2O4
Exact Mass 360.111007 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E3sVEMxXowu
Name 3-[[N-(Phenylpropargyl)amino]glyoxylyl]indole-2-acetic Acid
CAS Registry Number 138955-97-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H16N2O4
InChI InChI=1S/C21H16N2O4/c24-18(25)13-17-19(15-10-4-5-11-16(15)23-17)20(26)21(27)22-12-6-9-14-7-2-1-3-8-14/h1-5,7-8,10-11,23H,12-13H2,(H,22,27)(H,24,25)
InChIKey GJVKAZPNWLJYCH-UHFFFAOYSA-N
Molecular Weight 360.369 g/mol
SMILES [nH]1c2c(c(c1CC(=O)O)C(C(=O)NCC#Cc1ccccc1)=O)cccc2
SPLASH splash10-0a4i-0900000000-2a2e774de9ef99bc5b79
Source of Spectrum J-57-2110-14
Wiley ID 1348408