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3-(4-keto-4-methoxy-butanoyl)-1H-indole-2-carboxylic acid ethyl ester
SpectraBase Compound ID IGKJKCrnHQf
InChI InChI=1S/C16H17NO5/c1-3-22-16(20)15-14(12(18)8-9-13(19)21-2)10-6-4-5-7-11(10)17-15/h4-7,17H,3,8-9H2,1-2H3
InChIKey WAEWHWPBJIVZHW-UHFFFAOYSA-N
Mol Weight 303.31 g/mol
Molecular Formula C16H17NO5
Exact Mass 303.110673 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GVhlsPBUqdC
Name 3-(4-keto-4-methoxy-butanoyl)-1H-indole-2-carboxylic acid ethyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C16H17NO5
InChI InChI=1S/C16H17NO5/c1-3-22-16(20)15-14(12(18)8-9-13(19)21-2)10-6-4-5-7-11(10)17-15/h4-7,17H,3,8-9H2,1-2H3
InChIKey WAEWHWPBJIVZHW-UHFFFAOYSA-N
Molecular Weight 303.314 g/mol
SMILES [nH]1c2ccccc2c(c1C(=O)OCC)C(=O)CCC(=O)OC
SPLASH splash10-014i-0093000000-63755ac3897b70a6b5a5
Source of Spectrum E1-38-3264-3
Synonyms 3-(4-methoxy-1,4-dioxobutyl)-1H-indole-2-carboxylic acid ethyl ester ethyl 3-(4-methoxy-4-oxidanylidene-butanoyl)-1H-indole-2-carboxylate ethyl 3-(4-methoxy-4-oxo-butanoyl)-1H-indole-2-carboxylate
Wiley ID 1518502