| SpectraBase Compound ID | 2xsR3rxvOR5 |
|---|---|
| InChI | InChI=1S/C32H48N2O2S.2HI/c1-23-5-7-29(25-11-15-35-17-25)33(3)20-31(13-9-27(23)33)19-32(37-22-31)14-10-28-24(2)6-8-30(34(28,4)21-32)26-12-16-36-18-26;;/h11-12,15-18,23-24,27-30H,5-10,13-14,19-22H2,1-4H3;2*1H/q+2;;/p-2/t23-,24-,27+,28+,29+,30+,31+,32+,33+,34+;;/m0../s1 |
| InChIKey | OGUZEKXPMYKGKX-KCVGABRWSA-L |
| Mol Weight | 778.61695 g/mol |
| Molecular Formula | C32H48I2N2O2S |
| Exact Mass | 778.15259 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LrJkcQqGX64 |
|---|---|
| Name | THIOBINUPHARIDINE, BIS(IODOMETHYLATE) (ISOMER 4) |
| Comments | >) |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C32H48I2N2O2S |
| InChI | InChI=1S/C32H48N2O2S.2HI/c1-23-5-7-29(25-11-15-35-17-25)33(3)20-31(13-9-27(23)33)19-32(37-22-31)14-10-28-24(2)6-8-30(34(28,4)21-32)26-12-16-36-18-26;;/h11-12,15-18,23-24,27-30H,5-10,13-14,19-22H2,1-4H3;2*1H/q+2;;/p-2/t23-,24-,27+,28+,29+,30+,31+,32+,33+,34+;;/m0../s1 |
| InChIKey | OGUZEKXPMYKGKX-KCVGABRWSA-L |
| Instrument Name | Varian CFT-20 |
| Literature Reference | JACEK CYBULSKI, JANUSZ JURCZAK, KRYSTYNA WOJTASIEWICZ, JERZY T. WROBEL (1982)Bull. Polish Acad. Sci. (Chemistry): v.30, N1, 31-36. |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CD4O methanol-d4 |