| SpectraBase Compound ID | AP4QWvrwNvZ |
|---|---|
| InChI | InChI=1S/C14H25NO7/c16-13(1-2-14(17)18)15-3-5-19-7-9-21-11-12-22-10-8-20-6-4-15/h1-12H2,(H,17,18) |
| InChIKey | GTPNKJUSKCGEMP-UHFFFAOYSA-N |
| Mol Weight | 319.35 g/mol |
| Molecular Formula | C14H25NO7 |
| Exact Mass | 319.163102 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7rxOm3F2zvW |
|---|---|
| Name | 1,4,7,10-Tetraoxa-13-azacyclopentadecane-13-butanoic acid, .gamma.-oxo- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 319.163102142 u |
| Formula | C14H25NO7 |
| InChI | InChI=1S/C14H25NO7/c16-13(1-2-14(17)18)15-3-5-19-7-9-21-11-12-22-10-8-20-6-4-15/h1-12H2,(H,17,18) |
| InChIKey | GTPNKJUSKCGEMP-UHFFFAOYSA-N |
| Molecular Weight | 319.354 g/mol |
| SMILES | C1COCCOCCOCCN(CCO1)C(CCC(O)=O)=O |