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4-(Hexylamino)-1,2-naphthoquinone
SpectraBase Compound ID 6JhNPP6ljJE
InChI InChI=1S/C16H19NO2/c1-2-3-4-7-10-17-14-11-15(18)16(19)13-9-6-5-8-12(13)14/h5-6,8-9,11,17H,2-4,7,10H2,1H3
InChIKey UPLZKQNOPUZLCS-UHFFFAOYSA-N
Mol Weight 257.33 g/mol
Molecular Formula C16H19NO2
Exact Mass 257.141579 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 1WVRp23uDDV
Name 4-(Hexylamino)-1,2-naphthoquinone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 257.141578854 u
Formula C16H19NO2
InChI InChI=1S/C16H19NO2/c1-2-3-4-7-10-17-14-11-15(18)16(19)13-9-6-5-8-12(13)14/h5-6,8-9,11,17H,2-4,7,10H2,1H3
InChIKey UPLZKQNOPUZLCS-UHFFFAOYSA-N
Molecular Weight 257.333 g/mol
SMILES N(C1=CC(C(C=2C=CC=CC12)=O)=O)CCCCCC
Spectrum/Structure Validation Score (Raman) 0.811379