![1-[2-(3-FURYL)-5-METHYL-1-AZABICYCLO[4.4.0]DEC-8-YL]-1-[2-(3-FURYL)-5-METHYL-1-AZABICYCLO[4.4.0]DEC-7-EN-8-YL}-2-METHYLTHIOETHANE](/api/spectrum/9Av8THSgkKI/structure.png?h=300&w=458 "1-[2-(3-FURYL)-5-METHYL-1-AZABICYCLO[4.4.0]DEC-8-YL]-1-[2-(3-FURYL)-5-METHYL-1-AZABICYCLO[4.4.0]DEC-7-EN-8-YL}-2-METHYLTHIOETHANE")
| SpectraBase Compound ID | 76yEykdgIo9 |
|---|---|
| InChI | InChI=1S/C31H44N2O2S/c1-22-4-7-29(25-11-14-34-18-25)32-17-24(6-9-27(22)32)16-31(21-36-3)13-10-28-23(2)5-8-30(33(28)20-31)26-12-15-35-19-26/h6,11-12,14-15,18-19,22-23,27-30H,4-5,7-10,13,16-17,20-21H2,1-3H3/t22?,23?,27-,28?,29?,30?,31?/m0/s1 |
| InChIKey | HMTXUJAJNJCSFG-NEIKUEIWSA-N |
| Mol Weight | 508.8 g/mol |
| Molecular Formula | C31H44N2O2S |
| Exact Mass | 508.31235 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9Av8THSgkKI |
|---|---|
| Name | 1-[2-(3-FURYL)-5-METHYL-1-AZABICYCLO[4.4.0]DEC-8-YL]-1-[2-(3-FURYL)-5-METHYL-1-AZABICYCLO[4.4.0]DEC-7-EN-8-YL}-2-METHYLTHIOETHANE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C31H44N2O2S |
| InChI | InChI=1S/C31H44N2O2S/c1-22-4-7-29(25-11-14-34-18-25)32-17-24(6-9-27(22)32)16-31(21-36-3)13-10-28-23(2)5-8-30(33(28)20-31)26-12-15-35-19-26/h6,11-12,14-15,18-19,22-23,27-30H,4-5,7-10,13,16-17,20-21H2,1-3H3/t22?,23?,27-,28?,29?,30?,31?/m0/s1 |
| InChIKey | HMTXUJAJNJCSFG-NEIKUEIWSA-N |
| Instrument Name | Jeol FX-90 |
| Literature Reference | J.CYBULSKI, A.SCHOLL-ALEKSANDROWICZ, K.WOJTASIEWICZ, J.T.WROBEL (1987)Coll.Czech.Chem.Comm.: v.52, N8, 2083-2086. |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 chloroform-d |