SpectraBase Compound ID | 1MSfVTGR7fD |
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InChI | InChI=1S/C15H23NO3/c1-2-3-4-5-6-7-8-13-19-15-11-9-14(10-12-15)16(17)18/h9-12H,2-8,13H2,1H3 |
InChIKey | JLSCIQUWVGKSDH-UHFFFAOYSA-N |
Mol Weight | 265.35 g/mol |
Molecular Formula | C15H23NO3 |
Exact Mass | 265.167794 g/mol |
SpectraBase Spectrum ID | IeC7BuVrrIY |
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Name | 4-Nitrophenyl nonyl ether |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 265.167793602 u |
Formula | C15H23NO3 |
InChI | InChI=1S/C15H23NO3/c1-2-3-4-5-6-7-8-13-19-15-11-9-14(10-12-15)16(17)18/h9-12H,2-8,13H2,1H3 |
InChIKey | JLSCIQUWVGKSDH-UHFFFAOYSA-N |
Molecular Weight | 265.353 g/mol |
SMILES | C(CCCCCCCC)OC1=CC=C(C=C1)[N+](=O)[O-] |
Spectrum/Structure Validation Score (Raman) | 0.987259 |