| SpectraBase Compound ID | 7NzNyuViwx0 |
|---|---|
| InChI | InChI=1S/C12H26O5/c1-3-11(5-13,6-14)9-17-10-12(4-2,7-15)8-16/h13-16H,3-10H2,1-2H3 |
| InChIKey | WMYINDVYGQKYMI-UHFFFAOYSA-N |
| Mol Weight | 250.33 g/mol |
| Molecular Formula | C12H26O5 |
| Exact Mass | 250.178024 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | PIPQRZ6D6Z |
|---|---|
| Name | di(Trimethylolpropane) |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 250.178023932 u |
| Formula | C12H26O5 |
| InChI | InChI=1S/C12H26O5/c1-3-11(5-13,6-14)9-17-10-12(4-2,7-15)8-16/h13-16H,3-10H2,1-2H3 |
| InChIKey | WMYINDVYGQKYMI-UHFFFAOYSA-N |
| Molecular Weight | 250.335 g/mol |
| SMILES | C(OCC(CO)(CO)CC)C(CO)(CO)CC |
| Spectrum/Structure Validation Score (Raman) | 0.980616 |