SpectraBase Compound ID | H7u4MdzWozg |
---|---|
InChI | InChI=1S/C9H9F3O2/c1-13-6-14-8-4-2-3-7(5-8)9(10,11)12/h2-5H,6H2,1H3 |
InChIKey | ZVAJDXRDOOVXBO-UHFFFAOYSA-N |
Mol Weight | 206.16 g/mol |
Molecular Formula | C9H9F3O2 |
Exact Mass | 206.055464 g/mol |
SpectraBase Spectrum ID | 4Y7EWlqVaIv |
---|---|
Name | 1-(Methoxymethoxy)-3-(trifluoromethyl)benzene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 206.055464017 u |
Formula | C9H9F3O2 |
InChI | InChI=1S/C9H9F3O2/c1-13-6-14-8-4-2-3-7(5-8)9(10,11)12/h2-5H,6H2,1H3 |
InChIKey | ZVAJDXRDOOVXBO-UHFFFAOYSA-N |
Molecular Weight | 206.164 g/mol |
SMILES | C(C1=CC(OCOC)=CC=C1)(F)(F)F |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.956566 |