SpectraBase Spectrum ID |
37FRtWlxO9C |
Name |
Mefenorex-m (ho-methoxy-) P642 |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
257.118256586 u |
Formula |
C13H20ClNO2 |
InChI |
InChI=1S/C13H20ClNO2/c1-10(15-7-3-6-14)8-11-4-5-12(16)13(9-11)17-2/h4-5,9-10,15-16H,3,6-8H2,1-2H3 |
InChIKey |
TUFOMNCJDUPPPJ-UHFFFAOYSA-N |
Molecular Weight |
257.761 g/mol |
SMILES |
C=1C(=CC(OC)=C(C1)O)CC(C)NCCCCl |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95308 |