| SpectraBase Compound ID | 8ntQluhNIFr |
|---|---|
| InChI | InChI=1S/C14H24O5/c1-2-3-11-18-13(16)8-4-5-9-14(17)19-12-7-6-10-15/h2,15H,1,3-12H2 |
| InChIKey | MHEIBSWZIXKYOF-UHFFFAOYSA-N |
| Mol Weight | 272.34 g/mol |
| Molecular Formula | C14H24O5 |
| Exact Mass | 272.162374 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7UlF4bIcayz |
|---|---|
| Name | Butenyl butanediol adipate |
| 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/c1-2-3-11-18-13(16)8-4-5-9-14(17)19-12-7-6-10-15/h2,15H,1,3-12H2 |
| InChIKey | MHEIBSWZIXKYOF-UHFFFAOYSA-N |
| Molecular Weight | 272.341 g/mol |
| SMILES | C(CCCOC(CCCCC(OCCC=C)=O)=O)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.865786 |