| SpectraBase Compound ID | 8hA5PpBwjxM |
|---|---|
| InChI | InChI=1S/C19H27NO4/c1-18(2,3)16(21)23-14-9-8-13(10-11-20-7)12-15(14)24-17(22)19(4,5)6/h8-12,20H,1-7H3/b11-10+ |
| InChIKey | XUFJBUMQPSNTSZ-ZHACJKMWSA-N |
| Mol Weight | 333.43 g/mol |
| Molecular Formula | C19H27NO4 |
| Exact Mass | 333.194008 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I6fuy873Dth |
|---|---|
| Name | Dipivefrin -H2O P1115 |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 333.194008349 u |
| Formula | C19H27NO4 |
| InChI | InChI=1S/C19H27NO4/c1-18(2,3)16(21)23-14-9-8-13(10-11-20-7)12-15(14)24-17(22)19(4,5)6/h8-12,20H,1-7H3/b11-10+ |
| InChIKey | XUFJBUMQPSNTSZ-ZHACJKMWSA-N |
| Molecular Weight | 333.428 g/mol |
| SMILES | C=1C=C(C(=CC1\C=C\NC)OC(C(C)(C)C)=O)OC(=O)C(C)(C)C |