| SpectraBase Compound ID | 83rp0ETbhWO |
|---|---|
| InChI | InChI=1S/C15H12O4/c1-18-15-8-12(10-17)4-7-14(15)19-13-5-2-11(9-16)3-6-13/h2-10H,1H3 |
| InChIKey | VQWUQHBSHKQWTM-UHFFFAOYSA-N |
| Mol Weight | 256.26 g/mol |
| Molecular Formula | C15H12O4 |
| Exact Mass | 256.073559 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K6Sb4wAtrEs |
|---|---|
| Name | Vanillin benzaldehyde |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 256.073558862 u |
| Formula | C15H12O4 |
| InChI | InChI=1S/C15H12O4/c1-18-15-8-12(10-17)4-7-14(15)19-13-5-2-11(9-16)3-6-13/h2-10H,1H3 |
| InChIKey | VQWUQHBSHKQWTM-UHFFFAOYSA-N |
| Molecular Weight | 256.257 g/mol |
| SMILES | C1=C(C(=CC=C1C=O)OC=1C=CC(=CC1)C=O)OC |