| SpectraBase Spectrum ID |
4KNpUdH0XGD |
| Name |
3-Benzyl-9,10-dimethoxy-1,3,4,6,7,11B-hexahydro-2H-benzo[A]quinolizin-2-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
351.183443666 u |
| Formula |
C22H25NO3 |
| InChI |
InChI=1S/C22H25NO3/c1-25-21-11-16-8-9-23-14-17(10-15-6-4-3-5-7-15)20(24)13-19(23)18(16)12-22(21)26-2/h3-7,11-12,17,19H,8-10,13-14H2,1-2H3 |
| InChIKey |
YVZMJXWMXDNNGD-UHFFFAOYSA-N |
| Molecular Weight |
351.446 g/mol |
| SMILES |
C=12C=C(C(=CC1CCN1CC(C(CC21)=O)CC=1C=CC=CC1)OC)OC |
| Spectrum/Structure Validation Score (Raman) |
0.949837 |
![3-benzyl-9,10-dimethoxy-1,3,4,6,7,11b-hexahydro-2H-benzo[a]quinolizin-2-one](/api/spectrum/4KNpUdH0XGD/structure.png?h=300&w=458 "3-benzyl-9,10-dimethoxy-1,3,4,6,7,11b-hexahydro-2H-benzo[a]quinolizin-2-one")
