SpectraBase Compound ID | 4mY8fnUBIJM |
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InChI | InChI=1S/C13H9NO2/c15-14(16)11-6-5-10-7-9-3-1-2-4-12(9)13(10)8-11/h1-6,8H,7H2 |
InChIKey | CKAGNBSBBQJLCI-UHFFFAOYSA-N |
Mol Weight | 211.22 g/mol |
Molecular Formula | C13H9NO2 |
Exact Mass | 211.063329 g/mol |
SpectraBase Spectrum ID | FsNy0ST91D8 |
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Name | 9H-Fluorene, 3-nitro- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 211.063328532 u |
Formula | C13H9NO2 |
InChI | InChI=1S/C13H9NO2/c15-14(16)11-6-5-10-7-9-3-1-2-4-12(9)13(10)8-11/h1-6,8H,7H2 |
InChIKey | CKAGNBSBBQJLCI-UHFFFAOYSA-N |
Molecular Weight | 211.220 g/mol |
SMILES | C1=C2CC3=CC=C(N(=O)=O)C=C3C2=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.937529 |