| SpectraBase Spectrum ID |
7T6O81UBmGa |
| Name |
6H-[1]Benzopyrano[3',4':4,5]pyrrolo[1,2-B]isoquinoline, 6A,7,7A,8,13,14A-hexahydro-, (6A.alpha.,7A.beta.,14A.alpha.)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
277.146664235 u |
| Formula |
C19H19NO |
| InChI |
InChI=1S/C19H19NO/c1-2-6-14-11-20-16(9-13(14)5-1)10-15-12-21-18-8-4-3-7-17(18)19(15)20/h1-8,15-16,19H,9-12H2 |
| InChIKey |
LUKPNTOBXQKXPQ-UHFFFAOYSA-N |
| Molecular Weight |
277.367 g/mol |
| SMILES |
C12N3C(CC2COC2=C1C=CC=C2)CC1=C(C3)C=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.875389 |
![6H-[1]Benzopyrano[3',4':4,5]pyrrolo[1,2-b]isoquinoline, 6a,7,7a,8,13,14a-hexahydro-, (6a.alpha.,7a.beta.,14a.alpha.)-](/api/spectrum/7T6O81UBmGa/structure.png?h=300&w=458 "6H-[1]Benzopyrano[3',4':4,5]pyrrolo[1,2-b]isoquinoline, 6a,7,7a,8,13,14a-hexahydro-, (6a.alpha.,7a.beta.,14a.alpha.)-")
