| SpectraBase Compound ID | FPgfKAbn7bf |
|---|---|
| InChI | InChI=1S/C16H16ClN/c1-2-6-16(13-7-4-3-5-8-13)18-15-11-9-14(17)10-12-15/h2-5,7-12,16,18H,1,6H2 |
| InChIKey | UNQCEFAUOBWWQV-UHFFFAOYSA-N |
| Mol Weight | 257.76 g/mol |
| Molecular Formula | C16H16ClN |
| Exact Mass | 257.097127 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | Ic0O5GiOhfw |
|---|---|
| Name | 4-Chloro-N-(1-phenylbut-3-enyl)aniline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 257.097127219 u |
| Formula | C16H16ClN |
| InChI | InChI=1S/C16H16ClN/c1-2-6-16(13-7-4-3-5-8-13)18-15-11-9-14(17)10-12-15/h2-5,7-12,16,18H,1,6H2 |
| InChIKey | UNQCEFAUOBWWQV-UHFFFAOYSA-N |
| Molecular Weight | 257.764 g/mol |
| SMILES | C=1(NC(CC=C)C=2C=CC=CC2)C=CC(=CC1)Cl |