| SpectraBase Compound ID | JlrpNi69tA2 |
|---|---|
| InChI | InChI=1S/C12H23NO4/c1-12(2,3)17-11(16)13-9-7-5-4-6-8-10(14)15/h4-9H2,1-3H3,(H,13,16)(H,14,15) |
| InChIKey | HJENAZQPOGVAEK-UHFFFAOYSA-N |
| Mol Weight | 245.32 g/mol |
| Molecular Formula | C12H23NO4 |
| Exact Mass | 245.162708 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 | 9dGLCUAL1QI |
|---|---|
| Name | 7-Aminoheptanoic acid, N-T-butoxycarbonyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 245.162708221 u |
| Formula | C12H23NO4 |
| InChI | InChI=1S/C12H23NO4/c1-12(2,3)17-11(16)13-9-7-5-4-6-8-10(14)15/h4-9H2,1-3H3,(H,13,16)(H,14,15) |
| InChIKey | HJENAZQPOGVAEK-UHFFFAOYSA-N |
| Molecular Weight | 245.319 g/mol |
| SMILES | C(CCCCCC(O)=O)NC(=O)OC(C)(C)C |