| SpectraBase Compound ID | BhuEGYFsgG7 |
|---|---|
| InChI | InChI=1S/C20H37ClO4/c1-17(2)18(3)25-20(23)14-12-13-19(22)24-16-11-9-7-5-4-6-8-10-15-21/h17-18H,4-16H2,1-3H3 |
| InChIKey | MTMINCKAFSSFLS-UHFFFAOYSA-N |
| Mol Weight | 377.0 g/mol |
| Molecular Formula | C20H37ClO4 |
| Exact Mass | 376.238037 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6Unl7zOBQWe |
|---|---|
| Name | Glutaric acid, 3-methylbut-2-yl 10-chlorodecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 376.238037367 u |
| Formula | C20H37ClO4 |
| InChI | InChI=1S/C20H37ClO4/c1-17(2)18(3)25-20(23)14-12-13-19(22)24-16-11-9-7-5-4-6-8-10-15-21/h17-18H,4-16H2,1-3H3 |
| InChIKey | MTMINCKAFSSFLS-UHFFFAOYSA-N |
| Molecular Weight | 376.965 g/mol |
| SMILES | C(CCC(OCCCCCCCCCCCl)=O)C(OC(C(C)C)C)=O |