| SpectraBase Compound ID | 3LCDz5IJ76k |
|---|---|
| InChI | InChI=1S/C22H21NO3/c1-15(2)12-13-26-18-10-8-17(9-11-18)20-19(21(24)23-22(20)25)14-16-6-4-3-5-7-16/h3-12H,13-14H2,1-2H3,(H,23,24,25) |
| InChIKey | MTTHLOLASDKITP-UHFFFAOYSA-N |
| Mol Weight | 347.41 g/mol |
| Molecular Formula | C22H21NO3 |
| Exact Mass | 347.152144 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2bj18F0h1Fc |
|---|---|
| Name | Himanimide A |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 347.152143537 u |
| Formula | C22H21NO3 |
| InChI | InChI=1S/C22H21NO3/c1-15(2)12-13-26-18-10-8-17(9-11-18)20-19(21(24)23-22(20)25)14-16-6-4-3-5-7-16/h3-12H,13-14H2,1-2H3,(H,23,24,25) |
| InChIKey | MTTHLOLASDKITP-UHFFFAOYSA-N |
| Molecular Weight | 347.414 g/mol |
| SMILES | C1=C(OCC=C(C)C)C=CC(C2=C(C(NC2=O)=O)CC2=CC=CC=C2)=C1 |