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2-{[3-(Dimethylamino)propyl]amino}-1,4-naphthoquinone

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 Raman

2-{[3-(Dimethylamino)propyl]amino}-1,4-naphthoquinone
SpectraBase Compound ID JQnx5KcRJW
InChI InChI=1S/C15H18N2O2/c1-17(2)9-5-8-16-13-10-14(18)11-6-3-4-7-12(11)15(13)19/h3-4,6-7,10,16H,5,8-9H2,1-2H3
InChIKey FDFBRWBTHXMNBM-UHFFFAOYSA-N
Mol Weight 258.32 g/mol
Molecular Formula C15H18N2O2
Exact Mass 258.136828 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 92v6QPbfH1H
Name 2-{[3-(Dimethylamino)propyl]amino}-1,4-naphthoquinone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 258.136827826 u
Formula C15H18N2O2
InChI InChI=1S/C15H18N2O2/c1-17(2)9-5-8-16-13-10-14(18)11-6-3-4-7-12(11)15(13)19/h3-4,6-7,10,16H,5,8-9H2,1-2H3
InChIKey FDFBRWBTHXMNBM-UHFFFAOYSA-N
Molecular Weight 258.321 g/mol
SMILES N(C1=CC(C=2C=CC=CC2C1=O)=O)CCCN(C)C
Spectrum/Structure Validation Score (Raman) 0.816639