| SpectraBase Compound ID | 5ao13VCURJ2 |
|---|---|
| InChI | InChI=1S/C16H25NO3/c1-4-7-17(8-5-2)9-6-13-10-14(18-3)16-15(11-13)19-12-20-16/h10-11H,4-9,12H2,1-3H3 |
| InChIKey | ZASUXZWSAPNVQT-UHFFFAOYSA-N |
| Mol Weight | 279.38 g/mol |
| Molecular Formula | C16H25NO3 |
| Exact Mass | 279.183444 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GXpNnMqGhv8 |
|---|---|
| Name | N,N-Dipropyl-3-methoxy-4,5-methylenedioxyphenethylamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 279.183443666 u |
| Formula | C16H25NO3 |
| InChI | InChI=1S/C16H25NO3/c1-4-7-17(8-5-2)9-6-13-10-14(18-3)16-15(11-13)19-12-20-16/h10-11H,4-9,12H2,1-3H3 |
| InChIKey | ZASUXZWSAPNVQT-UHFFFAOYSA-N |
| SMILES | C1=2C(=C(C=C(C2)CCN(CCC)CCC)OC)OCO1 |