| SpectraBase Compound ID | 7zk5sYCbitG |
|---|---|
| InChI | InChI=1S/C15H18BrNO3/c1-2-9-20-15(19)13-7-4-8-17(13)14(18)11-5-3-6-12(16)10-11/h3,5-6,10,13H,2,4,7-9H2,1H3 |
| InChIKey | UKTZALHLCZTQTM-UHFFFAOYSA-N |
| Mol Weight | 340.22 g/mol |
| Molecular Formula | C15H18BrNO3 |
| Exact Mass | 339.047006 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 6vy092zbtAC |
|---|---|
| Name | L-Proline, N-(3-bromobenzoyl)-, propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 339.047006441 u |
| Formula | C15H18BrNO3 |
| InChI | InChI=1S/C15H18BrNO3/c1-2-9-20-15(19)13-7-4-8-17(13)14(18)11-5-3-6-12(16)10-11/h3,5-6,10,13H,2,4,7-9H2,1H3 |
| InChIKey | UKTZALHLCZTQTM-UHFFFAOYSA-N |
| Molecular Weight | 340.217 g/mol |
| SMILES | C1C(N(C(=O)C=2C=C(C=CC2)Br)CC1)C(=O)OCCC |