| SpectraBase Spectrum ID |
sKVAZwiHGb |
| Name |
7,8-Dimethoxy-2,3,10,10A-tetrahydro-1H-pyrrolo[1,2-B]isoquinolin-5-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
247.120843408 u |
| Formula |
C14H17NO3 |
| InChI |
InChI=1S/C14H17NO3/c1-17-12-7-9-6-10-4-3-5-15(10)14(16)11(9)8-13(12)18-2/h7-8,10H,3-6H2,1-2H3 |
| InChIKey |
WEMFCVOKISYHGS-UHFFFAOYSA-N |
| Molecular Weight |
247.294 g/mol |
| SMILES |
C1(N2C(CCC2)CC2=C1C=C(C(OC)=C2)OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.937584 |
![7,8-dimethoxy-2,3,10,10a-tetrahydro-1H-pyrrolo[1,2-b]isoquinolin-5-one](/api/spectrum/sKVAZwiHGb/structure.png?h=300&w=458 "7,8-dimethoxy-2,3,10,10a-tetrahydro-1H-pyrrolo[1,2-b]isoquinolin-5-one")
