| SpectraBase Compound ID | 23Ykjbg28Rl |
|---|---|
| InChI | InChI=1S/C13H22ClNO5/c1-2-4-17-6-8-19-10-11-20-9-7-18-5-3-15-13(16)12-14/h1H,3-12H2,(H,15,16) |
| InChIKey | UYCYHPAWBHGQCS-UHFFFAOYSA-N |
| Mol Weight | 307.77 g/mol |
| Molecular Formula | C13H22ClNO5 |
| Exact Mass | 307.118651 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5eqB4GhwH3x |
|---|---|
| Name | N-Chloroacetyl-3,6,9,12-tetraoxapentadec-14-yn-1-amine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 307.118650507 u |
| Formula | C13H22ClNO5 |
| InChI | InChI=1S/C13H22ClNO5/c1-2-4-17-6-8-19-10-11-20-9-7-18-5-3-15-13(16)12-14/h1H,3-12H2,(H,15,16) |
| InChIKey | UYCYHPAWBHGQCS-UHFFFAOYSA-N |
| Molecular Weight | 307.774 g/mol |
| SMILES | C(Cl)C(=O)NCCOCCOCCOCCOCC#C |