| SpectraBase Compound ID | EzmRwIjMylE |
|---|---|
| InChI | InChI=1S/C9H14O6/c1-6(10)13-4-9(15-8(3)12)5-14-7(2)11/h9H,4-5H2,1-3H3 |
| InChIKey | URAYPUMNDPQOKB-UHFFFAOYSA-N |
| Mol Weight | 218.2 g/mol |
| Molecular Formula | C9H14O6 |
| Exact Mass | 218.079038 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | EQxQRTFGlTL |
|---|---|
| Name | Triacetin |
| Apodization Function | Blackman-Harris 4-term |
| Copyright | Copyright © 2023-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 218.079038165 u |
| Formula | C9H14O6 |
| InChI | InChI=1S/C9H14O6/c1-6(10)13-4-9(15-8(3)12)5-14-7(2)11/h9H,4-5H2,1-3H3 |
| InChIKey | URAYPUMNDPQOKB-UHFFFAOYSA-N |
| Instrument Name | Bruker MultiRAM Stand Alone FT-Raman Spectrometer |
| Literature Reference | Be̅rziņš, K., Sales, R. E., Barnsley, J. E., Walker, G., Fraser-Miller, S. J., & Gordon, K. C. (2020). Reference data to the low-wavenumber Raman spectral database of pharamceutical excipients [Data set]. In Vibrational spectroscopy (1.1, p. 103021). Zenodo. |
| Literature Reference DOI | 10.5281/zenodo.3614035 |
| Resolution | 4 cm-1 |
| SMILES | C(C(OC(C)=O)COC(C)=O)OC(C)=O |
| Scans Performed | 128 |
| Source of Spectrum | Zenodo |
| X-Axis Maximum | 4001.81 |
| X-Axis Minimum | 202.533 |