| SpectraBase Compound ID | AHmot4eWwwI |
|---|---|
| InChI | InChI=1S/C28H51N/c1-4-6-8-10-12-14-16-20-24-29(26-28-23-19-18-22-27(28)3)25-21-17-15-13-11-9-7-5-2/h18-19,22-23H,4-17,20-21,24-26H2,1-3H3 |
| InChIKey | XSBMQDSWCGXPHE-UHFFFAOYSA-N |
| Mol Weight | 401.7 g/mol |
| Molecular Formula | C28H51N |
| Exact Mass | 401.402151 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L52U66qRpot |
|---|---|
| Name | 2-Methylbenzylamine, N,N-didecyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 401.402150646 u |
| Formula | C28H51N |
| InChI | InChI=1S/C28H51N/c1-4-6-8-10-12-14-16-20-24-29(26-28-23-19-18-22-27(28)3)25-21-17-15-13-11-9-7-5-2/h18-19,22-23H,4-17,20-21,24-26H2,1-3H3 |
| InChIKey | XSBMQDSWCGXPHE-UHFFFAOYSA-N |
| Molecular Weight | 401.723 g/mol |
| SMILES | C1=CC(C)=C(C=C1)CN(CCCCCCCCCC)CCCCCCCCCC |