| SpectraBase Compound ID | 6SgwPTfGyrG |
|---|---|
| InChI | InChI=1S/C10H12O3/c1-3-4-7-5-8(11)10(12)9(6-7)13-2/h3-6,11-12H,1-2H3 |
| InChIKey | PFDPUHAVILVFNN-UHFFFAOYSA-N |
| Mol Weight | 180.2 g/mol |
| Molecular Formula | C10H12O3 |
| Exact Mass | 180.078644 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H71cPzKUELP |
|---|---|
| Name | 1-(3-Methoxy-4,5-dihydroxybenzene)propene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 180.078644243 u |
| Formula | C10H12O3 |
| InChI | InChI=1S/C10H12O3/c1-3-4-7-5-8(11)10(12)9(6-7)13-2/h3-6,11-12H,1-2H3 |
| InChIKey | PFDPUHAVILVFNN-UHFFFAOYSA-N |
| Molecular Weight | 180.203 g/mol |
| SMILES | C=1(C=C(C(=C(C1)O)O)OC)\C=C\C |