| SpectraBase Compound ID | 4QFmGbyWDrU |
|---|---|
| InChI | InChI=1S/C19H22O3/c1-12-10-15(6-8-17(12)21)19(4,5)16-7-9-18(13(2)11-16)22-14(3)20/h6-11,21H,1-5H3 |
| InChIKey | DWHDRVVCZWXAAL-UHFFFAOYSA-N |
| Mol Weight | 298.38 g/mol |
| Molecular Formula | C19H22O3 |
| Exact Mass | 298.156895 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ew6wlVbMsIs |
|---|---|
| Name | Bisphenol C, acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.156894565 u |
| Formula | C19H22O3 |
| InChI | InChI=1S/C19H22O3/c1-12-10-15(6-8-17(12)21)19(4,5)16-7-9-18(13(2)11-16)22-14(3)20/h6-11,21H,1-5H3 |
| InChIKey | DWHDRVVCZWXAAL-UHFFFAOYSA-N |
| SMILES | C(C)(C)(C1=CC(C)=C(C=C1)O)C1=CC(C)=C(C=C1)OC(C)=O |