| SpectraBase Compound ID | 3W4sNXZsRUS |
|---|---|
| InChI | InChI=1S/C15H28O4/c1-14(2,12(16)17)10-8-6-5-7-9-11-15(3,4)13(18)19/h5-11H2,1-4H3,(H,16,17)(H,18,19) |
| InChIKey | KRGYRBZSOJWBAW-UHFFFAOYSA-N |
| Mol Weight | 272.38 g/mol |
| Molecular Formula | C15H28O4 |
| Exact Mass | 272.198759 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | FM8VsFoIkGJ |
|---|---|
| Name | Undecanedioic acid, 2,2,10,10-tetramethyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 272.198759378 u |
| Formula | C15H28O4 |
| InChI | InChI=1S/C15H28O4/c1-14(2,12(16)17)10-8-6-5-7-9-11-15(3,4)13(18)19/h5-11H2,1-4H3,(H,16,17)(H,18,19) |
| InChIKey | KRGYRBZSOJWBAW-UHFFFAOYSA-N |
| SMILES | CC(C(O)=O)(CCCCCCCC(C)(C(O)=O)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.942799 |