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(5S*,6aS*)-6,6a-Dihydro-5-(N-methylacetamid)isoindolo[2,1-a]quinoline-11(5H)-one
SpectraBase Compound ID LyBEhRwKpMo
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
Mol Weight 306.37 g/mol
Molecular Formula C19H18N2O2
Exact Mass 306.136828 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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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