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1H-Indole-3-acetic acid, 2-formyl-, ethyl ester

View entire compound with spectra: 1 MS (GC)

1H-Indole-3-acetic acid, 2-formyl-, ethyl ester
SpectraBase Compound ID DHyYwfGTOv6
InChI InChI=1S/C13H13NO3/c1-2-17-13(16)7-10-9-5-3-4-6-11(9)14-12(10)8-15/h3-6,8,14H,2,7H2,1H3
InChIKey IIUNDJCKJFESTK-UHFFFAOYSA-N
Mol Weight 231.25 g/mol
Molecular Formula C13H13NO3
Exact Mass 231.089543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JLgEEfNOyqD
Name 1H-Indole-3-acetic acid, 2-formyl-, ethyl ester
CAS Registry Number 118361-81-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13NO3
InChI InChI=1S/C13H13NO3/c1-2-17-13(16)7-10-9-5-3-4-6-11(9)14-12(10)8-15/h3-6,8,14H,2,7H2,1H3
InChIKey IIUNDJCKJFESTK-UHFFFAOYSA-N
Molecular Weight 231.251 g/mol
SMILES [nH]1c2c(c(c1C=O)CC(=O)OCC)cccc2
SPLASH splash10-0a59-0930000000-9e17159489271e316e41
Source of Spectrum KC-1988-1410-4
Synonyms Ethyl (2-formyl-1H-indol-3-yl)acetate Ethyl 2-formylindol-3-ylacetate Ethyl 2-(2-formyl-1H-indol-3-yl)acetate Ethyl 2-(2-methanoyl-1H-indol-3-yl)ethanoate
Wiley ID 1232776