![7-[( o-Chlorobenzyl)oxy]-2,2,5-trimethyl-4-chromanone](/api/spectrum/6bTTiHd3IAu/structure.png?h=300&w=458 "7-[( o-Chlorobenzyl)oxy]-2,2,5-trimethyl-4-chromanone")
| SpectraBase Compound ID | 3UnZN38AyYS |
|---|---|
| InChI | InChI=1S/C19H19ClO3/c1-12-8-14(22-11-13-6-4-5-7-15(13)20)9-17-18(12)16(21)10-19(2,3)23-17/h4-9H,10-11H2,1-3H3 |
| InChIKey | INKHULMRUNNHDT-UHFFFAOYSA-N |
| Mol Weight | 330.81 g/mol |
| Molecular Formula | C19H19ClO3 |
| Exact Mass | 330.102272 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6bTTiHd3IAu |
|---|---|
| Name | 7-[( o-Chlorobenzyl)oxy]-2,2,5-trimethyl-4-chromanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 330.102272169 u |
| Formula | C19H19ClO3 |
| InChI | InChI=1S/C19H19ClO3/c1-12-8-14(22-11-13-6-4-5-7-15(13)20)9-17-18(12)16(21)10-19(2,3)23-17/h4-9H,10-11H2,1-3H3 |
| InChIKey | INKHULMRUNNHDT-UHFFFAOYSA-N |
| Molecular Weight | 330.811 g/mol |
| SMILES | C1(CC(C=2C(=CC(=CC2O1)OCC=1C(=CC=CC1)Cl)C)=O)(C)C |