| SpectraBase Spectrum ID |
9iNMqlZreAo |
| Name |
Benzazepin, 3,4-dihydro-1-[2-[3,4,5-trimethoxyphenyl]ethyl]-7,8-dimetho |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
399.204573033 u |
| Formula |
C23H29NO5 |
| InChI |
InChI=1S/C23H29NO5/c1-25-19-13-16-7-6-10-24-18(17(16)14-20(19)26-2)9-8-15-11-21(27-3)23(29-5)22(12-15)28-4/h11-14H,6-10H2,1-5H3 |
| InChIKey |
FTVMXBMFTVPNOF-UHFFFAOYSA-N |
| Molecular Weight |
399.487 g/mol |
| SMILES |
C1(=C(C=C2C(=C1)C(=NCCC2)CCC1=CC(=C(C(=C1)OC)OC)OC)OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.983754 |
![Benzazepin, 3,4-dihydro-1-[2-[3,4,5-trimethoxyphenyl]ethyl]-7,8-dimetho](/api/spectrum/9iNMqlZreAo/structure.png?h=300&w=458 "Benzazepin, 3,4-dihydro-1-[2-[3,4,5-trimethoxyphenyl]ethyl]-7,8-dimetho")
