| SpectraBase Compound ID | HoZSL49u2xB |
|---|---|
| InChI | InChI=1S/C23H26O3/c1-16(2)14-20-21(23(20,3)4)22(24)25-15-17-10-12-19(13-11-17)26-18-8-6-5-7-9-18/h5-14,20-21H,15H2,1-4H3 |
| InChIKey | IKNKTZXNADDXFN-UHFFFAOYSA-N |
| Mol Weight | 350.46 g/mol |
| Molecular Formula | C23H26O3 |
| Exact Mass | 350.188195 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CBIQ6jJewIo |
|---|---|
| Name | Phenothrin P1209 |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 350.188194694 u |
| Formula | C23H26O3 |
| InChI | InChI=1S/C23H26O3/c1-16(2)14-20-21(23(20,3)4)22(24)25-15-17-10-12-19(13-11-17)26-18-8-6-5-7-9-18/h5-14,20-21H,15H2,1-4H3 |
| InChIKey | IKNKTZXNADDXFN-UHFFFAOYSA-N |
| Molecular Weight | 350.458 g/mol |
| SMILES | C1=CC(OC2=CC=CC=C2)=CC=C1COC(C1C(C1(C)C)C=C(C)C)=O |