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Phenyl 1-(p-tolyl)-1H-indole-3-sulfonate
SpectraBase Compound ID GjmtxgnyyqT
InChI InChI=1S/C21H17NO3S/c1-16-11-13-17(14-12-16)22-15-21(19-9-5-6-10-20(19)22)26(23,24)25-18-7-3-2-4-8-18/h2-15H,1H3
InChIKey FCYFQUKXXWGZCG-UHFFFAOYSA-N
Mol Weight 363.43 g/mol
Molecular Formula C21H17NO3S
Exact Mass 363.092915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5eVkTLVBWT
Name Phenyl 1-(p-tolyl)-1H-indole-3-sulfonate
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 363.092914582 u
Formula C21H17NO3S
InChI InChI=1S/C21H17NO3S/c1-16-11-13-17(14-12-16)22-15-21(19-9-5-6-10-20(19)22)26(23,24)25-18-7-3-2-4-8-18/h2-15H,1H3
InChIKey FCYFQUKXXWGZCG-UHFFFAOYSA-N
Instrument Name Agilent 5975N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201612565
Molecular Weight 363.431 g/mol
Quality 40
Reported Formula C21H16NO3S
SMILES C1(S(OC2=CC=CC=C2)(=O)=O)=CN(C2=C1C=CC=C2)C1=CC=C(C=C1)C
SPLASH splash10-01t9-0591000000-f8898cbdc22ad5ab926f
Source of Spectrum ACI-56-SM31-4b (DOI: 10.1002/anie.201612565)
Wiley ID 1895551