| SpectraBase Compound ID | C6jc0j0wA7g |
|---|---|
| InChI | InChI=1S/C18H29ClO4/c1-3-16(2)23-18(21)13-12-17(20)22-15-11-9-7-5-4-6-8-10-14-19/h1,16H,4-15H2,2H3 |
| InChIKey | KSNSNAHDIPUFPX-UHFFFAOYSA-N |
| Mol Weight | 344.88 g/mol |
| Molecular Formula | C18H29ClO4 |
| Exact Mass | 344.175437 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 | 7Qa8UbIJcDt |
|---|---|
| Name | Succinic acid, but-3-yn-2-yl 10-chlorodecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 344.175437110 u |
| Formula | C18H29ClO4 |
| InChI | InChI=1S/C18H29ClO4/c1-3-16(2)23-18(21)13-12-17(20)22-15-11-9-7-5-4-6-8-10-14-19/h1,16H,4-15H2,2H3 |
| InChIKey | KSNSNAHDIPUFPX-UHFFFAOYSA-N |
| Molecular Weight | 344.879 g/mol |
| SMILES | C(CC(OC(C#C)C)=O)C(OCCCCCCCCCCCl)=O |