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1H-Isoindole-1,3(2H)-dione, 2-[3-(3,4-dihydro-2-methyl-1(2H)-quinolinyl)propyl]-
SpectraBase Compound ID 4tBjQ5fqrar
InChI InChI=1S/C21H22N2O2/c1-15-11-12-16-7-2-5-10-19(16)22(15)13-6-14-23-20(24)17-8-3-4-9-18(17)21(23)25/h2-5,7-10,15H,6,11-14H2,1H3
InChIKey AZADVMLMVPOMPL-UHFFFAOYSA-N
Mol Weight 334.42 g/mol
Molecular Formula C21H22N2O2
Exact Mass 334.168128 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID ECNmR4IeeqV
Name 1H-Isoindole-1,3(2H)-dione, 2-[3-(3,4-dihydro-2-methyl-1(2H)-quinolinyl)propyl]-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 334.168127954 u
Formula C21H22N2O2
InChI InChI=1S/C21H22N2O2/c1-15-11-12-16-7-2-5-10-19(16)22(15)13-6-14-23-20(24)17-8-3-4-9-18(17)21(23)25/h2-5,7-10,15H,6,11-14H2,1H3
InChIKey AZADVMLMVPOMPL-UHFFFAOYSA-N
Molecular Weight 334.419 g/mol
SMILES CC1CCC=2C(N1CCCN1C(=O)C3=CC=CC=C3C1=O)=CC=CC2
Spectrum/Structure Validation Score (Vapor Phase IR) 0.930314