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45cEiZldZo
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45cEiZldZo
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3-(4-keto-4-methoxy-butyl)-1H-indole-2-carboxylic acid ethyl ester
SpectraBase Compound ID HUEeUvu2bze
InChI InChI=1S/C16H19NO4/c1-3-21-16(19)15-12(8-6-10-14(18)20-2)11-7-4-5-9-13(11)17-15/h4-5,7,9,17H,3,6,8,10H2,1-2H3
InChIKey MPNDMVDMJDQIBD-UHFFFAOYSA-N
Mol Weight 289.33 g/mol
Molecular Formula C16H19NO4
Exact Mass 289.131408 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 45cEiZldZo
Name 3-(4-keto-4-methoxy-butyl)-1H-indole-2-carboxylic acid ethyl ester
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19NO4
InChI InChI=1S/C16H19NO4/c1-3-21-16(19)15-12(8-6-10-14(18)20-2)11-7-4-5-9-13(11)17-15/h4-5,7,9,17H,3,6,8,10H2,1-2H3
InChIKey MPNDMVDMJDQIBD-UHFFFAOYSA-N
Molecular Weight 289.331 g/mol
SMILES [nH]1c2ccccc2c(c1C(=O)OCC)CCCC(=O)OC
SPLASH splash10-0a4r-0890000000-c8557c844656bf255222
Source of Spectrum E1-42-451-34
Synonyms 3-(4-methoxy-4-oxobutyl)-1H-indole-2-carboxylic acid ethyl ester ethyl 3-(4-methoxy-4-oxidanylidene-butyl)-1H-indole-2-carboxylate ethyl 3-(4-methoxy-4-oxo-butyl)-1H-indole-2-carboxylate
Wiley ID 1552411
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