| SpectraBase Spectrum ID |
1WCShTAjZ5a |
| Name |
(1sr,10Bsr)-8,9-dimethoxy-1,10B-dimethyl-1,5,6,10B-tetrahydropyrrolo[2,1-A]isoquinolin-3-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
275.152143537 u |
| Formula |
C16H21NO3 |
| InChI |
InChI=1S/C16H21NO3/c1-10-7-15(18)17-6-5-11-8-13(19-3)14(20-4)9-12(11)16(10,17)2/h8-10H,5-7H2,1-4H3/t10-,16-/m0/s1 |
| InChIKey |
AYBSXIVLPQGRAW-QFYYESIMSA-N |
| Molecular Weight |
275.348 g/mol |
| SMILES |
[C@]12(N(C(=O)C[C@@]2(C)[H])CCC2=C1C=C(OC)C(=C2)OC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.966747 |
![(1sr,10Bsr)-8,9-dimethoxy-1,10B-dimethyl-1,5,6,10B-tetrahydropyrrolo[2,1-A]isoquinolin-3-one](/api/spectrum/1WCShTAjZ5a/structure.png?h=300&w=458 "(1sr,10Bsr)-8,9-dimethoxy-1,10B-dimethyl-1,5,6,10B-tetrahydropyrrolo[2,1-A]isoquinolin-3-one")
