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3,4-DIHYDROISOQUINOLINE-2-(1-H)-SULFONAMIDE
SpectraBase Compound ID 32mUbelFPA6
InChI InChI=1S/C9H12N2O2S/c10-14(12,13)11-6-5-8-3-1-2-4-9(8)7-11/h1-4H,5-7H2,(H2,10,12,13)
InChIKey RERPSPPBSSELBR-UHFFFAOYSA-N
Mol Weight 212.27 g/mol
Molecular Formula C9H12N2O2S
Exact Mass 212.061949 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F84ZBNErB8W
Name 3,4-DIHYDROISOQUINOLINE-2-(1-H)-SULFONAMIDE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H12N2O2S
InChI InChI=1S/C9H12N2O2S/c10-14(12,13)11-6-5-8-3-1-2-4-9(8)7-11/h1-4H,5-7H2,(H2,10,12,13)
InChIKey RERPSPPBSSELBR-UHFFFAOYSA-N
Literature Reference Author R.GITTO,S.AGNELLO,S.FERRO,L.DELUCA,D.VULLO,J.BRYNDA,P.MADER, C.T.SUPURAN,A.CHIMIR
Literature Reference Citation J.MED.CHEM.,53,2401(2010)
Literature Reference DOI 10.1021/jm9014026
Molecular Weight 212.266 g/mol
Solvent DMSO-D6
Source File Reference UWMZ46567