| SpectraBase Spectrum ID |
IxWtW5mQH3f |
| Name |
(+-)-1'-phenyl-6',7',1'',10A'-tetrahydrospiro(cyclopentane-1,3'-pyrido[1,2-A]azepin)-3-en-4'-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
291.162314299 u |
| Formula |
C20H21NO |
| InChI |
InChI=1S/C20H21NO/c22-19-20(12-6-7-13-20)15-17(16-9-3-1-4-10-16)18-11-5-2-8-14-21(18)19/h1-7,9-10,15,18H,8,11-14H2 |
| InChIKey |
SZWJXCXHZFYHKX-UHFFFAOYSA-N |
| SMILES |
C1(N2C(C(=CC11CC=CC1)C=1C=CC=CC1)CC=CCC2)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.869925 |
![(+-)-1'-Phenyl-6',7',1'',10a'-tetrahydrospiro(cyclopentane-1,3'-pyrido[1,2-a]azepin)-3-en-4'-one](/api/spectrum/IxWtW5mQH3f/structure.png?h=300&w=458 "(+-)-1'-Phenyl-6',7',1'',10a'-tetrahydrospiro(cyclopentane-1,3'-pyrido[1,2-a]azepin)-3-en-4'-one")
