| SpectraBase Compound ID | CcsQ1goOqDC |
|---|---|
| InChI | InChI=1S/C11H12O3/c1-2-3-9(12)8-4-5-10-11(6-8)14-7-13-10/h2,4-6,9,12H,1,3,7H2 |
| InChIKey | QFBKADULYGBKQY-UHFFFAOYSA-N |
| Mol Weight | 192.21 g/mol |
| Molecular Formula | C11H12O3 |
| Exact Mass | 192.078644 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 9pwwj5fc2g9 |
|---|---|
| Name | 1-(1,3-Benzodioxol-5-yl)-3-buten-1-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 192.078644243 u |
| Formula | C11H12O3 |
| InChI | InChI=1S/C11H12O3/c1-2-3-9(12)8-4-5-10-11(6-8)14-7-13-10/h2,4-6,9,12H,1,3,7H2 |
| InChIKey | QFBKADULYGBKQY-UHFFFAOYSA-N |
| Molecular Weight | 192.214 g/mol |
| SMILES | C12=CC(C(O)CC=C)=CC=C2OCO1 |