| SpectraBase Compound ID | BZvvWXGeyrJ |
|---|---|
| InChI | InChI=1S/C18H25IN2O3/c1-20-16-10-17(23-3)14(9-15(16)19)18(22)24-13-7-11-5-4-6-12(8-13)21(11)2/h9-13,20H,4-8H2,1-3H3/t11-,12+,13+ |
| InChIKey | HEHJAEWALQPPCN-ITGUQSILSA-N |
| Mol Weight | 444.31 g/mol |
| Molecular Formula | C18H25IN2O3 |
| Exact Mass | 444.090988 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8jGslUjlazc |
|---|---|
| Name | 5-iodo-4-(methylamino)-o-anisic acid, homotropan-3-yl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H25IN2O3 |
| InChI | InChI=1S/C18H25IN2O3/c1-20-16-10-17(23-3)14(9-15(16)19)18(22)24-13-7-11-5-4-6-12(8-13)21(11)2/h9-13,20H,4-8H2,1-3H3/t11-,12+,13+ |
| InChIKey | HEHJAEWALQPPCN-ITGUQSILSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 49203M |
| Solvent | DMSO-d6 |