| SpectraBase Spectrum ID |
DCSS6ZGQGhS |
| Name |
4-Oxododecanedioic acid, 2me derivative |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
272.162373868 u |
| Formula |
C14H24O5 |
| InChI |
InChI=1S/C14H24O5/c1-18-13(16)9-7-5-3-4-6-8-12(15)10-11-14(17)19-2/h3-11H2,1-2H3 |
| InChIKey |
FBUFTJMJHRFXNW-UHFFFAOYSA-N |
| Molecular Weight |
272.341 g/mol |
| SMILES |
C(=O)(OC)CCCCCCCC(CCC(=O)OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.990737 |
