| SpectraBase Compound ID | 2ql43kE4zRV |
|---|---|
| InChI | InChI=1S/C16H27NO3/c1-5-6-7-9-17-10-8-13-11-14(18-2)16(20-4)15(12-13)19-3/h11-12,17H,5-10H2,1-4H3 |
| InChIKey | ZSAMIZIDADBKSR-UHFFFAOYSA-N |
| Mol Weight | 281.4 g/mol |
| Molecular Formula | C16H27NO3 |
| Exact Mass | 281.199094 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8bNixNk11VS |
|---|---|
| Name | N-Pentylmescaline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 281.199093730 u |
| Formula | C16H27NO3 |
| InChI | InChI=1S/C16H27NO3/c1-5-6-7-9-17-10-8-13-11-14(18-2)16(20-4)15(12-13)19-3/h11-12,17H,5-10H2,1-4H3 |
| InChIKey | ZSAMIZIDADBKSR-UHFFFAOYSA-N |
| SMILES | C1(=C(C=C(C=C1OC)CCNCCCCC)OC)OC |