SpectraBase Spectrum ID |
64sMWNDRKJa |
Name |
4'-Hydroxy-3'-nitrodecanophenone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
293.162708221 u |
Formula |
C16H23NO4 |
InChI |
InChI=1S/C16H23NO4/c1-2-3-4-5-6-7-8-9-15(18)13-10-11-16(19)14(12-13)17(20)21/h10-12,19H,2-9H2,1H3 |
InChIKey |
FDSPIUFETCZXHQ-UHFFFAOYSA-N |
Molecular Weight |
293.363 g/mol |
SMILES |
OC=1C(=CC(=CC1)C(CCCCCCCCC)=O)N(=O)=O |
Spectrum/Structure Validation Score (Raman) |
0.918314 |