| SpectraBase Compound ID | 3cUY7vhhqCc |
|---|---|
| InChI | InChI=1S/C29H38N2O2S/c1-7-33-25-16-14-24(15-17-25)30-28(34)31-27(32)20-22(3)11-8-10-21(2)13-18-26-23(4)12-9-19-29(26,5)6/h8,10-11,13-18,20H,7,9,12,19H2,1-6H3,(H2,30,31,32,34)/b11-8+,18-13+,21-10+,22-20+ |
| InChIKey | NDFKETVVQMPPSB-FSDIUQKZSA-N |
| Mol Weight | 478.7 g/mol |
| Molecular Formula | C29H38N2O2S |
| Exact Mass | 478.2654 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E6Ev9Euq2gJ |
|---|---|
| Name | N1-Retinoyl-N2-(4-ethoxy-phenyl)-thiourea |
| CAS Registry Number | 54155-03-2 |
| Comments | WHE-6401-47 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C29H38N2O2S |
| InChI | InChI=1S/C29H38N2O2S/c1-7-33-25-16-14-24(15-17-25)30-28(34)31-27(32)20-22(3)11-8-10-21(2)13-18-26-23(4)12-9-19-29(26,5)6/h8,10-11,13-18,20H,7,9,12,19H2,1-6H3,(H2,30,31,32,34)/b11-8+,18-13+,21-10+,22-20+ |
| InChIKey | NDFKETVVQMPPSB-FSDIUQKZSA-N |
| Instrument Name | Bruker WP-80 |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |