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8-METHYLSULFONYL-2,3,4,5-TETRAHYDRO-1H-2-BENZAZEPINE
SpectraBase Compound ID BltxjUUcBA7
InChI InChI=1S/C11H15NO2S/c1-15(13,14)11-5-4-9-3-2-6-12-8-10(9)7-11/h4-5,7,12H,2-3,6,8H2,1H3
InChIKey YYBLSOFLVWZZIK-UHFFFAOYSA-N
Mol Weight 225.31 g/mol
Molecular Formula C11H15NO2S
Exact Mass 225.08235 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H4sVRUjIFQs
Name 8-METHYLSULFONYL-2,3,4,5-TETRAHYDRO-1H-2-BENZAZEPINE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H15NO2S
InChI InChI=1S/C11H15NO2S/c1-15(13,14)11-5-4-9-3-2-6-12-8-10(9)7-11/h4-5,7,12H,2-3,6,8H2,1H3
InChIKey YYBLSOFLVWZZIK-UHFFFAOYSA-N
Literature Reference Author G.L.GRUNEWALD,V.H.DAHANUKAR,K.R.CRISCIONE
Literature Reference Citation BIOORG.MED.CHEM.,9,1957(2001)
Literature Reference DOI 10.1016/S0968-0896(01)00112-2
Molecular Weight 225.306 g/mol
Solvent CDCl3
Source File Reference UWMS22066