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2-Chloroethyl 1-phenyl-1H-pyrrolo[2,3-b]pyridine-3-sulfonate
SpectraBase Compound ID Jd0l9JnvF7K
InChI InChI=1S/C15H13ClN2O3S/c16-8-10-21-22(19,20)14-11-18(12-5-2-1-3-6-12)15-13(14)7-4-9-17-15/h1-7,9,11H,8,10H2
InChIKey RGJRQYWQEOFOFR-UHFFFAOYSA-N
Mol Weight 336.79 g/mol
Molecular Formula C15H13ClN2O3S
Exact Mass 336.033541 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J3OJHiWcwr4
Name 2-Chloroethyl 1-phenyl-1H-pyrrolo[2,3-b]pyridine-3-sulfonate
Appearance White solid
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Exact Mass 336.033541158 u
Formula C15H13ClN2O3S
InChI InChI=1S/C15H13ClN2O3S/c16-8-10-21-22(19,20)14-11-18(12-5-2-1-3-6-12)15-13(14)7-4-9-17-15/h1-7,9,11H,8,10H2
InChIKey RGJRQYWQEOFOFR-UHFFFAOYSA-N
Instrument Name Agilent 5975N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201612565
Molecular Weight 336.793 g/mol
Reported Formula C15H13ClN2O3S
SMILES C1(S(OCCCl)(=O)=O)=CN(C2=C1C=CC=N2)C1=CC=CC=C1
SPLASH splash10-000f-0916000000-a80f8aa65d91d7decd52
Source of Spectrum ACI-56-SM26-2y (DOI: 10.1002/anie.201612565)
Wiley ID 1895539