| SpectraBase Spectrum ID |
9Pphf9CRAEU |
| Name |
Dimethyl heptadecanedioate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
328.261359635 u |
| Formula |
C19H36O4 |
| InChI |
InChI=1S/C19H36O4/c1-22-18(20)16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19(21)23-2/h3-17H2,1-2H3 |
| InChIKey |
YIZQYNRKVWQMJO-UHFFFAOYSA-N |
| Molecular Weight |
328.493 g/mol |
| SMILES |
C(CCCCCCCCCCCCCC(=O)OC)CC(OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.970377 |
