| SpectraBase Compound ID | Aqo413mHIfZ |
|---|---|
| InChI | InChI=1S/C18H21N/c1-3-16(2)19(14-17-10-6-4-7-11-17)15-18-12-8-5-9-13-18/h3-13,16H,1,14-15H2,2H3/t16-/m0/s1 |
| InChIKey | HKKYHDXUGDUWIN-INIZCTEOSA-N |
| Mol Weight | 251.37 g/mol |
| Molecular Formula | C18H21N |
| Exact Mass | 251.1674 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EkGFOxPnHi8 |
|---|---|
| Name | (2S)-N,N-Dibenzylbut-3-en-2-amine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 251.167399680 u |
| Formula | C18H21N |
| InChI | InChI=1S/C18H21N/c1-3-16(2)19(14-17-10-6-4-7-11-17)15-18-12-8-5-9-13-18/h3-13,16H,1,14-15H2,2H3/t16-/m0/s1 |
| InChIKey | HKKYHDXUGDUWIN-INIZCTEOSA-N |
| Molecular Weight | 251.373 g/mol |
| SMILES | C(N(CC=1C=CC=CC1)[C@](C=C)(C)[H])C=1C=CC=CC1 |