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6-Chloromethyl-2-(toluene-4-sulfonyl)-2,3-dihydro-1H-pyrrolo[3,4-c]pyridine
SpectraBase Compound ID GQPo7wv40vW
InChI InChI=1S/C15H15ClN2O2S/c1-11-2-4-15(5-3-11)21(19,20)18-9-12-6-14(7-16)17-8-13(12)10-18/h2-6,8H,7,9-10H2,1H3
InChIKey DAOIUSUEKKJMBW-UHFFFAOYSA-N
Mol Weight 322.81 g/mol
Molecular Formula C15H15ClN2O2S
Exact Mass 322.054277 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5u6C6D1sf2r
Name 6-Chloromethyl-2-(toluene-4-sulfonyl)-2,3-dihydro-1H-pyrrolo[3,4-c]pyridine
Comments Less than 3 mono-isotopic peaks
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Formula C15H15ClN2O2S
InChI InChI=1S/C15H15ClN2O2S/c1-11-2-4-15(5-3-11)21(19,20)18-9-12-6-14(7-16)17-8-13(12)10-18/h2-6,8H,7,9-10H2,1H3
InChIKey DAOIUSUEKKJMBW-UHFFFAOYSA-N
Molecular Weight 322.810 g/mol
SMILES C1N(S(c2ccc(cc2)C)(=O)=O)Cc2cc(ncc12)CCl
SPLASH splash10-014i-0903000000-abf29f7e83ced5a47c3e
Source of Spectrum QE-12-5628-4
Synonyms 2-Chloromethyl-6-tosyl-5,6-dihydro-7H-pyrrolo[3,4-c]pyridine 6-(chloromethyl)-2-[(4-methylphenyl)sulfonyl]-2,3-dihydro-1H-pyrrolo[3,4-c]pyridine
Wiley ID 1587139