| SpectraBase Spectrum ID |
Ehofu8YwsPA |
| Name |
(7R,7ar) 1-Benzyl-7-cyano-7-methylhexahydro-1H-opyrrolo[1,2-A]imidazole |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
241.157897624 u |
| Formula |
C15H19N3 |
| InChI |
InChI=1S/C15H19N3/c1-15(12-16)7-8-17-9-10-18(14(15)17)11-13-5-3-2-4-6-13/h2-6,14H,7-11H2,1H3/t14-,15+/m1/s1 |
| InChIKey |
NGHJQWVDIVYREG-CABCVRRESA-N |
| Molecular Weight |
241.338 g/mol |
| SMILES |
[C@@]12(N(CCN1CC[C@]2(C#N)C)CC=1C=CC=CC1)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.825122 |
![(7R,7aR) 1-Benzyl-7-cyano-7-methylhexahydro-1H-opyrrolo[1,2-a]imidazole](/api/spectrum/Ehofu8YwsPA/structure.png?h=300&w=458 "(7R,7aR) 1-Benzyl-7-cyano-7-methylhexahydro-1H-opyrrolo[1,2-a]imidazole")
