SpectraBase Spectrum ID |
IuP7UGljkHK |
Name |
Methyl N-[2,4-difluoro-3-(hydroxymethyl)phenyl]carbamate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
217.055049477 u |
Formula |
C9H9F2NO3 |
InChI |
InChI=1S/C9H9F2NO3/c1-15-9(14)12-7-3-2-6(10)5(4-13)8(7)11/h2-3,13H,4H2,1H3,(H,12,14) |
InChIKey |
SPPUCESLNNJUGL-UHFFFAOYSA-N |
Molecular Weight |
217.172 g/mol |
SMILES |
C1=C(C(CO)=C(C(=C1)NC(OC)=O)F)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.856002 |