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m-Tolyl 1-phenyl-1H-indole-3-sulfonate
SpectraBase Compound ID 2p1qzPvPHwN
InChI InChI=1S/C21H17NO3S/c1-16-8-7-11-18(14-16)25-26(23,24)21-15-22(17-9-3-2-4-10-17)20-13-6-5-12-19(20)21/h2-15H,1H3
InChIKey DQHBUCQWWUZPCU-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 AnFU89Z1IiM
Name m-Tolyl 1-phenyl-1H-indole-3-sulfonate
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 363.092914582 u
Formula C21H17NO3S
InChI InChI=1S/C21H17NO3S/c1-16-8-7-11-18(14-16)25-26(23,24)21-15-22(17-9-3-2-4-10-17)20-13-6-5-12-19(20)21/h2-15H,1H3
InChIKey DQHBUCQWWUZPCU-UHFFFAOYSA-N
Instrument Name Agilent 5975N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201612565
Molecular Weight 363.431 g/mol
Quality 39
Reported Formula C21H17NO3S
SMILES C1(S(OC2=CC(=CC=C2)C)(=O)=O)=CN(C2=C1C=CC=C2)C1=CC=CC=C1
SPLASH splash10-0a6r-0190000000-47c6ae8270c380b59db4
Source of Spectrum ACI-56-SM36-4m (DOI: 10.1002/anie.201612565)
Wiley ID 1895561