| SpectraBase Spectrum ID |
J3hNWdtPI57 |
| Name |
(1S,5S)-2-Methyl-5-(1-methylethenyl)-N-(phenylmethyl)-1-cyclohex-2-enamine |
| 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/c1-13(2)16-10-9-14(3)17(11-16)18-12-15-7-5-4-6-8-15/h4-9,16-18H,1,10-12H2,2-3H3/t16-,17-/m0/s1 |
| InChIKey |
PNRSEGAFCAJTSL-IRXDYDNUSA-N |
| Molecular Weight |
241.378 g/mol |
| SMILES |
C=1([C@](C[C@](CC1)(C(=C)C)[H])(NCC=1C=CC=CC1)[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.951643 |
