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TRANS-12-CYCLOHEXYLTHIO-6,10B,11,12-TETRAHYDRO-PYRROLO-[1',2':2,3]-PYRIDAZINO-[6,1-A]-ISOINDOL-6-ONE
SpectraBase Compound ID FN6hWS7I2pP
InChI InChI=1S/C20H22N2OS/c23-20-16-10-5-4-9-15(16)18-13-19(24-14-7-2-1-3-8-14)17-11-6-12-21(17)22(18)20/h4-6,9-12,14,18-19H,1-3,7-8,13H2/t18-,19+/m1/s1
InChIKey UEFOGUMUVRSAGC-MOPGFXCFSA-N
Mol Weight 338.47 g/mol
Molecular Formula C20H22N2OS
Exact Mass 338.145285 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9CuaUoPSYq8
Name TRANS-12-CYCLOHEXYLTHIO-6,10B,11,12-TETRAHYDRO-PYRROLO-[1',2':2,3]-PYRIDAZINO-[6,1-A]-ISOINDOL-6-ONE
Compound Number 7E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H22N2OS
InChI InChI=1S/C20H22N2OS/c23-20-16-10-5-4-9-15(16)18-13-19(24-14-7-2-1-3-8-14)17-11-6-12-21(17)22(18)20/h4-6,9-12,14,18-19H,1-3,7-8,13H2/t18-,19+/m1/s1
InChIKey UEFOGUMUVRSAGC-MOPGFXCFSA-N
Literature Reference Author S.MARCHALIN,B.DECROIX
Literature Reference Citation HETEROCYCLES,43,2595(1996)
Literature Reference DOI 10.3987/COM-96-7559
Molecular Weight 338.467 g/mol
Solvent CDCl3
Source File Reference UWCP6301