| SpectraBase Spectrum ID |
1Ctj3J9YH5G |
| Name |
N-Allyl-N-methyl-1-phenylhept-2-yn-1-amine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
241.183049745 u |
| Formula |
C17H23N |
| InChI |
InChI=1S/C17H23N/c1-4-6-7-11-14-17(18(3)15-5-2)16-12-9-8-10-13-16/h5,8-10,12-13,17H,2,4,6-7,15H2,1,3H3 |
| InChIKey |
UGJNWVZMZLTFNP-UHFFFAOYSA-N |
| Molecular Weight |
241.378 g/mol |
| SMILES |
C(C#CCCCC)(N(C)CC=C)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.936841 |
