| SpectraBase Compound ID | I6CRkIj9k2Z |
|---|---|
| InChI | InChI=1S/C17H21NO3/c1-19-15-11-9-18-7-6-17(5-3-2-4-14(17)18)12(11)8-13-16(15)21-10-20-13/h8,14H,2-7,9-10H2,1H3 |
| InChIKey | NZPAORYINCRHQL-UHFFFAOYSA-N |
| Mol Weight | 287.36 g/mol |
| Molecular Formula | C17H21NO3 |
| Exact Mass | 287.152144 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3dAwcXTi3Z9 |
|---|---|
| Name | Crinan, 7-methoxy- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 287.152143537 u |
| Formula | C17H21NO3 |
| InChI | InChI=1S/C17H21NO3/c1-19-15-11-9-18-7-6-17(5-3-2-4-14(17)18)12(11)8-13-16(15)21-10-20-13/h8,14H,2-7,9-10H2,1H3 |
| InChIKey | NZPAORYINCRHQL-UHFFFAOYSA-N |
| SMILES | COC1=C2C(C34C(N(C2)CC4)CCCC3)=CC2=C1OCO2 |