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Phenyl 1-phenyl-1H-pyrrolo[2,3-b]pyridine-3-sulfonate
SpectraBase Compound ID 27AKCbEygFI
InChI InChI=1S/C19H14N2O3S/c22-25(23,24-16-10-5-2-6-11-16)18-14-21(15-8-3-1-4-9-15)19-17(18)12-7-13-20-19/h1-14H
InChIKey NANLXLLAYCUTFL-UHFFFAOYSA-N
Mol Weight 350.39 g/mol
Molecular Formula C19H14N2O3S
Exact Mass 350.072513 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Dm4IBfchOq
Name Phenyl 1-phenyl-1H-pyrrolo[2,3-b]pyridine-3-sulfonate
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 350.072513490 u
Formula C19H14N2O3S
InChI InChI=1S/C19H14N2O3S/c22-25(23,24-16-10-5-2-6-11-16)18-14-21(15-8-3-1-4-9-15)19-17(18)12-7-13-20-19/h1-14H
InChIKey NANLXLLAYCUTFL-UHFFFAOYSA-N
Instrument Name Agilent 5975N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201612565
Molecular Weight 350.392 g/mol
Quality 42
Reported Formula C19H14N2O3S
SMILES C1(S(OC2=CC=CC=C2)(=O)=O)=CN(C2=C1C=CC=N2)C1=CC=CC=C1
SPLASH splash10-056r-0190000000-5b692078a3b66bd66601
Source of Spectrum ACI-56-SM34-4i (DOI: 10.1002/anie.201612565)
Wiley ID 1895557