SpectraBase Compound ID | 1qmub2ukjEf |
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InChI | InChI=1S/C10H7NO2/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5H,11H2 |
InChIKey | IGONFFFOEMASIA-UHFFFAOYSA-N |
Mol Weight | 173.17 g/mol |
Molecular Formula | C10H7NO2 |
Exact Mass | 173.047678 g/mol |
SpectraBase Spectrum ID | AQmBw0QR17P |
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Name | 4-Amino-1,2-naphthoquinone |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 173.047678467 u |
Formula | C10H7NO2 |
InChI | InChI=1S/C10H7NO2/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5H,11H2 |
InChIKey | IGONFFFOEMASIA-UHFFFAOYSA-N |
SMILES | NC=1C=2C=CC=CC2C(=O)C(=O)C1 |
Spectrum/Structure Validation Score (Raman) | 0.884421 |