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dimethyl 2-indol-1-ylpropanedioate
SpectraBase Compound ID 8bfLpS2UY3n
InChI InChI=1S/C13H13NO4/c1-17-12(15)11(13(16)18-2)14-8-7-9-5-3-4-6-10(9)14/h3-8,11H,1-2H3
InChIKey DPPNRQIBKMONEE-UHFFFAOYSA-N
Mol Weight 247.25 g/mol
Molecular Formula C13H13NO4
Exact Mass 247.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8EGkaqcxgz0
Name dimethyl 2-indol-1-ylpropanedioate
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13NO4
InChI InChI=1S/C13H13NO4/c1-17-12(15)11(13(16)18-2)14-8-7-9-5-3-4-6-10(9)14/h3-8,11H,1-2H3
InChIKey DPPNRQIBKMONEE-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP2010 or Agilent 5975C
Ionization Type EI
Literature Reference DOI 10.1002/anie.201910864
Molecular Weight 247.250 g/mol
Reported Formula C13H13NO4
SMILES C(C(C(=O)OC)[n]1ccc2c1cccc2)(=O)OC
SPLASH splash10-000j-0930000000-69d56be8d3c1a799df64
Source of Spectrum ACI-59-SM23-12
Wiley ID 1856822