| SpectraBase Compound ID | KjKDuI1Oo9C |
|---|---|
| InChI | InChI=1S/C8H8O3/c1-11-8-4-6(5-9)2-3-7(8)10/h2-5,10H,1H3 |
| InChIKey | MWOOGOJBHIARFG-UHFFFAOYSA-N |
| Mol Weight | 152.15 g/mol |
| Molecular Formula | C8H8O3 |
| Exact Mass | 152.047344 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1Y4brhrVOP0 |
|---|---|
| Name | Vanillin |
| Catalog Number | 36422 |
| CAS Registry Number | 121-33-5 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H8O3 |
| InChI | InChI=1S/C8H8O3/c1-11-8-4-6(5-9)2-3-7(8)10/h2-5,10H,1H3 |
| InChIKey | MWOOGOJBHIARFG-UHFFFAOYSA-N |
| Molecular Weight | 152.149 g/mol |
| SMILES | Oc1ccc(C=O)cc1OC |
| SPLASH | splash10-0udi-6900000000-230000c055c04bb9b311 |
| Source of Spectrum | CAY-2023-8-0 |
| Wiley ID | 1887974 |