| SpectraBase Compound ID | B7cz9zffExb |
|---|---|
| InChI | InChI=1S/C23H41N/c1-4-6-8-10-12-16-20-24(19-15-11-9-7-5-2)21-23-18-14-13-17-22(23)3/h13-14,17-18H,4-12,15-16,19-21H2,1-3H3 |
| InChIKey | FKRTXUCVBIMHSW-UHFFFAOYSA-N |
| Mol Weight | 331.6 g/mol |
| Molecular Formula | C23H41N |
| Exact Mass | 331.3239 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FLM3VcZPKtk |
|---|---|
| Name | 2-Methylbenzylamine, N-heptyl-N-octyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 331.323900324 u |
| Formula | C23H41N |
| InChI | InChI=1S/C23H41N/c1-4-6-8-10-12-16-20-24(19-15-11-9-7-5-2)21-23-18-14-13-17-22(23)3/h13-14,17-18H,4-12,15-16,19-21H2,1-3H3 |
| InChIKey | FKRTXUCVBIMHSW-UHFFFAOYSA-N |
| Molecular Weight | 331.588 g/mol |
| SMILES | C1=CC(C)=C(C=C1)CN(CCCCCCC)CCCCCCCC |