| SpectraBase Compound ID | CWUXbiTT33J |
|---|---|
| InChI | InChI=1S/C21H17NO3S/c1-24-15-10-12-16(13-11-15)25-14-21(23)22-17-6-2-4-8-19(17)26-20-9-5-3-7-18(20)22/h2-13H,14H2,1H3 |
| InChIKey | KVBXPCNSNDYNJQ-UHFFFAOYSA-N |
| Mol Weight | 363.43 g/mol |
| Molecular Formula | C21H17NO3S |
| Exact Mass | 363.092915 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7bb4ZBfPFw4 |
|---|---|
| Name | 10-(4'-Methoxyphenoxyacetyl)phenothiazine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 363.092914582 u |
| Formula | C21H17NO3S |
| InChI | InChI=1S/C21H17NO3S/c1-24-15-10-12-16(13-11-15)25-14-21(23)22-17-6-2-4-8-19(17)26-20-9-5-3-7-18(20)22/h2-13H,14H2,1H3 |
| InChIKey | KVBXPCNSNDYNJQ-UHFFFAOYSA-N |
| Molecular Weight | 363.431 g/mol |
| SMILES | C1=2N(C3=C(SC2C=CC=C1)C=CC=C3)C(COC1=CC=C(C=C1)OC)=O |