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6-Bromo-2,4-dichloro-5-((4-methoxy-3,5-dimethylphenyl)sulfinyl)-1-(methoxymethyl)-1H-pyrrolo[2,3-b]pyridine
SpectraBase Compound ID 3rPuNVf8aB3
InChI InChI=1S/C18H17BrCl2N2O3S/c1-9-5-11(6-10(2)15(9)26-4)27(24)16-14(21)12-7-13(20)23(8-25-3)18(12)22-17(16)19/h5-7H,8H2,1-4H3
InChIKey QRLBJZYJRFOPQF-UHFFFAOYSA-N
Mol Weight 492.22 g/mol
Molecular Formula C18H17BrCl2N2O3S
Exact Mass 489.952032 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BKvTMxf9L1u
Name 6-Bromo-2,4-dichloro-5-((4-methoxy-3,5-dimethylphenyl)sulfinyl)-1-(methoxymethyl)-1H-pyrrolo[2,3-b]pyridine
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Formula C18H17BrCl2N2O3S
InChI InChI=1S/C18H17BrCl2N2O3S/c1-9-5-11(6-10(2)15(9)26-4)27(24)16-14(21)12-7-13(20)23(8-25-3)18(12)22-17(16)19/h5-7H,8H2,1-4H3
InChIKey QRLBJZYJRFOPQF-UHFFFAOYSA-N
Literature Reference DOI 10.1002/anie.201303490
Molecular Weight 492.215 g/mol
SMILES c1(c(c2cc(Cl)[n](c2nc1Br)COC)Cl)S(=O)c1cc(c(c(c1)C)OC)C
SPLASH splash10-0ue9-1900100000-2a5ab72925e14e669f39
Source of Spectrum ACI-52-SM13-14a
Wiley ID 1781522