| SpectraBase Spectrum ID |
6TeaZc4tApD |
| Name |
(E)-4-[1-(1-Cyclohexenyl)ethenyl]-2-methyl-N-(phenylmethyl)-4-hexen-3-amine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
309.245650002 u |
| Formula |
C22H31N |
| InChI |
InChI=1S/C22H31N/c1-5-21(18(4)20-14-10-7-11-15-20)22(17(2)3)23-16-19-12-8-6-9-13-19/h5-6,8-9,12-14,17,22-23H,4,7,10-11,15-16H2,1-3H3/b21-5+ |
| InChIKey |
NRJZXYAJNHITLS-IGCPIRJNSA-N |
| SMILES |
C(\C(C(NCC=1C=CC=CC1)C(C)C)=C/C)(C1=CCCCC1)=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.945725 |
![(E)-4-[1-(1-cyclohexenyl)ethenyl]-2-methyl-N-(phenylmethyl)-4-hexen-3-amine](/api/spectrum/6TeaZc4tApD/structure.png?h=300&w=458 "(E)-4-[1-(1-cyclohexenyl)ethenyl]-2-methyl-N-(phenylmethyl)-4-hexen-3-amine")
