SpectraBase Spectrum ID |
1ge83AZqTcP |
Name |
(5S*,6as*)-6,6A-Dihydro-5-(N-methylacetamid)isoindolo[2,1-A]quinoline-11(5H)-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
306.136827826 u |
Formula |
C19H18N2O2 |
InChI |
InChI=1S/C19H18N2O2/c1-12(22)20(2)17-11-18-13-7-3-4-8-14(13)19(23)21(18)16-10-6-5-9-15(16)17/h3-10,17-18H,11H2,1-2H3/t17-,18-/m0/s1 |
InChIKey |
QQUFTLUEQAFCSB-ROUUACIJSA-N |
Molecular Weight |
306.365 g/mol |
SMILES |
C1(N2[C@](C=3C=CC=CC13)(C[C@](N(C(=O)C)C)(C=1C2=CC=CC1)[H])[H])=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.817961 |