| SpectraBase Compound ID | IPb6EFe1Wy5 |
|---|---|
| InChI | InChI=1S/C7H6O2.Na/c8-7(9)6-4-2-1-3-5-6;/h1-5H,(H,8,9);/q;+1/p-1 |
| InChIKey | WXMKPNITSTVMEF-UHFFFAOYSA-M |
| Mol Weight | 144.10476928 g/mol |
| Molecular Formula | C7H5NaO2 |
| Exact Mass | 144.018724 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | AtiForuVzZS |
|---|---|
| Name | Sodium benzoate |
| Apodization Function | Blackman-Harris 4-term |
| Copyright | Copyright © 2023-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 144.018723679 u |
| Formula | C7H5NaO2 |
| InChI | InChI=1S/C7H6O2.Na/c8-7(9)6-4-2-1-3-5-6;/h1-5H,(H,8,9);/q;+1/p-1 |
| InChIKey | WXMKPNITSTVMEF-UHFFFAOYSA-M |
| 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 | [Na+].C1=CC=C(C=C1)C(=O)[O-] |
| Scans Performed | 128 |
| Source of Spectrum | Zenodo |
| X-Axis Maximum | 4001.81 |
| X-Axis Minimum | 202.533 |