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5A-(PARA-TOLYL)-5A,5B,6,7,8,9,9A,11-OCTAHYDROISOINDOLO-[2,3-A]-BENZIMIDAZOL-10-ONE
SpectraBase Compound ID EQJZ3B2oNrE
InChI InChI=1S/C21H21NOS/c1-14-10-12-15(13-11-14)21-17-7-3-2-6-16(17)20(23)22(21)18-8-4-5-9-19(18)24-21/h4-5,8-13,16-17H,2-3,6-7H2,1H3
InChIKey AAEXQKIQJQDRFA-UHFFFAOYSA-N
Mol Weight 335.47 g/mol
Molecular Formula C21H21NOS
Exact Mass 335.134385 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6bcZ9OvmzQz
Name 5A-(PARA-TOLYL)-5A,5B,6,7,8,9,9A,11-OCTAHYDROISOINDOLO-[2,3-A]-BENZIMIDAZOL-10-ONE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H21NOS
InChI InChI=1S/C21H21NOS/c1-14-10-12-15(13-11-14)21-17-7-3-2-6-16(17)20(23)22(21)18-8-4-5-9-19(18)24-21/h4-5,8-13,16-17H,2-3,6-7H2,1H3
InChIKey AAEXQKIQJQDRFA-UHFFFAOYSA-N
Literature Reference Author G.STAJER,F.CSENDE,G.BERNATH,P.SOHAR
Literature Reference Citation HETEROCYCLES,37,883(1994)
Literature Reference DOI 10.3987/COM-93-S80
Molecular Weight 335.464 g/mol
Solvent CDCl3
Source File Reference UWCP1386