| SpectraBase Spectrum ID |
Dw5xqXq2c6J |
| Name |
2,3-Dichlorobenzyl alcohol, heptafluorobutyrate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
371.955481940 u |
| Formula |
C11H5Cl2F7O2 |
| InChI |
InChI=1S/C11H5Cl2F7O2/c12-6-3-1-2-5(7(6)13)4-22-8(21)9(14,15)10(16,17)11(18,19)20/h1-3H,4H2 |
| InChIKey |
VNRZOVZQXXBCJH-UHFFFAOYSA-N |
| Molecular Weight |
373.054 g/mol |
| SMILES |
C1(=C(C(=CC=C1)Cl)Cl)COC(=O)C(C(C(F)(F)F)(F)F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.920876 |
