| SpectraBase Compound ID | EZNSrgytTFD |
|---|---|
| InChI | InChI=1S/C28H35N5O/c1-17(2)21-15-23-24(28(6,7)13-12-27(23,4)5)16-22(21)18(3)14-19-8-10-20(11-9-19)25(34)29-26-30-32-33-31-26/h8-11,14-17H,12-13H2,1-7H3,(H2,29,30,31,32,33,34)/b18-14+ |
| InChIKey | UDPCQJQADQRKNM-NBVRZTHBSA-N |
| Mol Weight | 457.6 g/mol |
| Molecular Formula | C28H35N5O |
| Exact Mass | 457.284161 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ea1vuLciQnv |
|---|---|
| Name | 1-(4-Tetrazolylaminocarbonyl-phenyl)-trans-2-(7-isopropyl-1,1,4,4-tetramethyl-tetralinyl)-propene |
| CAS Registry Number | 87634-94-4 |
| Comments | WHE-8590-79 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C28H35N5O |
| InChI | InChI=1S/C28H35N5O/c1-17(2)21-15-23-24(28(6,7)13-12-27(23,4)5)16-22(21)18(3)14-19-8-10-20(11-9-19)25(34)29-26-30-32-33-31-26/h8-11,14-17H,12-13H2,1-7H3,(H2,29,30,31,32,33,34)/b18-14+ |
| InChIKey | UDPCQJQADQRKNM-NBVRZTHBSA-N |
| Instrument Name | Bruker WM-360 |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | DMSO-D6 |