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Indan-1,3-dione, 2-[(4-dimethylamino)benzyl]-

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 MS (GC)

Indan-1,3-dione, 2-[(4-dimethylamino)benzyl]-
SpectraBase Compound ID 6JXGhTun6l2
InChI InChI=1S/C18H17NO2/c1-19(2)13-9-7-12(8-10-13)11-16-17(20)14-5-3-4-6-15(14)18(16)21/h3-10,16H,11H2,1-2H3
InChIKey AQIIYOOEJQOCQO-UHFFFAOYSA-N
Mol Weight 279.34 g/mol
Molecular Formula C18H17NO2
Exact Mass 279.125929 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1k5wyAQl5b2
Name Indan-1,3-dione, 2-[(4-dimethylamino)benzyl]-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 279.125928789 u
Formula C18H17NO2
InChI InChI=1S/C18H17NO2/c1-19(2)13-9-7-12(8-10-13)11-16-17(20)14-5-3-4-6-15(14)18(16)21/h3-10,16H,11H2,1-2H3
InChIKey AQIIYOOEJQOCQO-UHFFFAOYSA-N
SMILES C1(C(C2=CC=CC=C2C1=O)=O)CC=1C=CC(=CC1)N(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.916452