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Ethyl 7-Methylthiomethyl-1H-indole-2-carboxylate
SpectraBase Compound ID EEa9Podo45u
InChI InChI=1S/C13H15NO2S/c1-3-16-13(15)11-7-9-5-4-6-10(8-17-2)12(9)14-11/h4-7,14H,3,8H2,1-2H3
InChIKey NUNIIZPGISRDNR-UHFFFAOYSA-N
Mol Weight 249.33 g/mol
Molecular Formula C13H15NO2S
Exact Mass 249.08235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JS8TlqslVOv
Name Ethyl 7-Methylthiomethyl-1H-indole-2-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C13H15NO2S
InChI InChI=1S/C13H15NO2S/c1-3-16-13(15)11-7-9-5-4-6-10(8-17-2)12(9)14-11/h4-7,14H,3,8H2,1-2H3
InChIKey NUNIIZPGISRDNR-UHFFFAOYSA-N
Molecular Weight 249.328 g/mol
SMILES [nH]1c2c(cccc2cc1C(=O)OCC)CSC
SPLASH splash10-0a4i-0930000000-ab95df4fb35494e246e8
Source of Spectrum E1-41-1918-2
Synonyms ethyl 7-[(methylsulfanyl)methyl]-1H-indole-2-carboxylate
Wiley ID 1552221