| SpectraBase Spectrum ID |
Iw4NbbYo89q |
| Name |
1,5-Pentanediol, o,o'-di(acetoxyacetyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
304.115817596 u |
| Formula |
C13H20O8 |
| InChI |
InChI=1S/C13H20O8/c1-10(14)20-8-12(16)18-6-4-3-5-7-19-13(17)9-21-11(2)15/h3-9H2,1-2H3 |
| InChIKey |
LJGZWMXAQAUBGM-UHFFFAOYSA-N |
| Molecular Weight |
304.295 g/mol |
| SMILES |
C(CCCCOC(COC(C)=O)=O)OC(COC(C)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.928781 |
