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5-methoxy-7-methylsulfonyloxy-1H-indole-2-carboxylic acid ethyl ester
SpectraBase Compound ID BBadl9SaBja
InChI InChI=1S/C13H15NO6S/c1-4-19-13(15)10-6-8-5-9(18-2)7-11(12(8)14-10)20-21(3,16)17/h5-7,14H,4H2,1-3H3
InChIKey SSMBEWGBQMCNFS-UHFFFAOYSA-N
Mol Weight 313.32 g/mol
Molecular Formula C13H15NO6S
Exact Mass 313.062008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G2uvr8nuxgU
Name 5-methoxy-7-methylsulfonyloxy-1H-indole-2-carboxylic acid ethyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C13H15NO6S
InChI InChI=1S/C13H15NO6S/c1-4-19-13(15)10-6-8-5-9(18-2)7-11(12(8)14-10)20-21(3,16)17/h5-7,14H,4H2,1-3H3
InChIKey SSMBEWGBQMCNFS-UHFFFAOYSA-N
Molecular Weight 313.324 g/mol
SMILES [nH]1c2c(cc(cc2cc1C(=O)OCC)OC)OS(=O)(=O)C
SPLASH splash10-001i-0093000000-9b3666c56300c38ebca7
Source of Spectrum E2-47-797-14
Wiley ID 1554896