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(5-bromanyl-1H-indol-7-yl) 4-methylbenzenesulfonate
SpectraBase Compound ID 6hY8KDoF5Bu
InChI InChI=1S/C15H12BrNO3S/c1-10-2-4-13(5-3-10)21(18,19)20-14-9-12(16)8-11-6-7-17-15(11)14/h2-9,17H,1H3
InChIKey XBUNURPGMQELPI-UHFFFAOYSA-N
Mol Weight 366.23 g/mol
Molecular Formula C15H12BrNO3S
Exact Mass 364.972127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fk2SbcbDHUv
Name (5-bromanyl-1H-indol-7-yl) 4-methylbenzenesulfonate
Comments Less than 3 mono-isotopic peaks
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Formula C15H12BrNO3S
InChI InChI=1S/C15H12BrNO3S/c1-10-2-4-13(5-3-10)21(18,19)20-14-9-12(16)8-11-6-7-17-15(11)14/h2-9,17H,1H3
InChIKey XBUNURPGMQELPI-UHFFFAOYSA-N
Molecular Weight 366.229 g/mol
SMILES [nH]1ccc2cc(cc(c12)OS(c1ccc(cc1)C)(=O)=O)Br
SPLASH splash10-03xr-0089000000-f010c33f04fdeecef167
Source of Spectrum PS-54-61-46
Synonyms (5-bromo-1H-indol-7-yl) 4-methylbenzenesulfonate 4-methylbenzenesulfonic acid (5-bromo-1H-indol-7-yl) ester
Wiley ID 805208