SpectraBase Spectrum ID |
CDrQUMgP4pZ |
Name |
Benzene, 1-[[(2,2-difluoro-3,3-dimethylcyclopropyl)methoxy]methyl]-3-phenoxy- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
318.143136208 u |
Formula |
C19H20F2O2 |
InChI |
InChI=1S/C19H20F2O2/c1-18(2)17(19(18,20)21)13-22-12-14-7-6-10-16(11-14)23-15-8-4-3-5-9-15/h3-11,17H,12-13H2,1-2H3 |
InChIKey |
BRMMRQMJXRLTIC-UHFFFAOYSA-N |
Molecular Weight |
318.364 g/mol |
SMILES |
C1(C(COCC=2C=C(OC=3C=CC=CC3)C=CC2)C1(C)C)(F)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.892864 |