| SpectraBase Compound ID | 97T4oCPSQgZ |
|---|---|
| InChI | InChI=1S/C10H18N2O3/c1-11-5-7-12(8-6-11)9(13)3-2-4-10(14)15/h2-8H2,1H3,(H,14,15) |
| InChIKey | ITHJVGXJNVDHIQ-UHFFFAOYSA-N |
| Mol Weight | 214.26 g/mol |
| Molecular Formula | C10H18N2O3 |
| Exact Mass | 214.131742 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 | 2GiBVfT774s |
|---|---|
| Name | 5-(4-Methylpiperazin-1-yl)-5-oxopentanoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 214.131742445 u |
| Formula | C10H18N2O3 |
| InChI | InChI=1S/C10H18N2O3/c1-11-5-7-12(8-6-11)9(13)3-2-4-10(14)15/h2-8H2,1H3,(H,14,15) |
| InChIKey | ITHJVGXJNVDHIQ-UHFFFAOYSA-N |
| Molecular Weight | 214.265 g/mol |
| SMILES | C(CCCC(O)=O)(=O)N1CCN(CC1)C |