SpectraBase Spectrum ID |
Hkk9MRH3rQq |
Name |
1H,5H-Benzo[ij]quinolizin-8-ol, 9,9'-methylenebis[2,3,6,7-tetrahydro-; 7,7'-methylenebis(2,3,6,7-tetrahydrobenzo[I,J]quinolizine-8,8'-diol) |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
390.230728212 u |
Formula |
C25H30N2O2 |
InChI |
InChI=1S/C25H30N2O2/c28-24-18(13-16-5-1-9-26-11-3-7-20(24)22(16)26)15-19-14-17-6-2-10-27-12-4-8-21(23(17)27)25(19)29/h13-14,28-29H,1-12,15H2 |
InChIKey |
OWQDWHCEAPVUGV-UHFFFAOYSA-N |
Molecular Weight |
390.527 g/mol |
SMILES |
OC1=C(CC2=C(C=3CCCN4CCCC(=C2)C34)O)C=C2CCCN3CCCC1=C23 |
Spectrum/Structure Validation Score (Raman) |
0.88454 |