| SpectraBase Spectrum ID |
4UblmhqvAjl |
| Name |
Succinic acid, di(non-5-yn-3-yl) ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
362.245709571 u |
| Formula |
C22H34O4 |
| InChI |
InChI=1S/C22H34O4/c1-5-9-11-13-15-19(7-3)25-21(23)17-18-22(24)26-20(8-4)16-14-12-10-6-2/h19-20H,5-10,15-18H2,1-4H3 |
| InChIKey |
KJICUWATRWVPME-UHFFFAOYSA-N |
| Molecular Weight |
362.510 g/mol |
| SMILES |
C(CC(OC(CC)CC#CCCC)=O)C(OC(CC#CCCC)CC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.844529 |
