SpectraBase Compound ID | JslqsiWlBGC |
---|---|
InChI | InChI=1S/C3Cl6F2/c4-2(5,6)1(10,11)3(7,8)9 |
InChIKey | YXVCODVAPNKSMC-UHFFFAOYSA-N |
Mol Weight | 286.7 g/mol |
Molecular Formula | C3Cl6F2 |
Exact Mass | 283.809923 g/mol |
SpectraBase Spectrum ID | 8qYadOFVURW |
---|---|
Name | 1,1,1,3,3,3-Hexachloro-2,2-difluoro-propane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 283.809922526 u |
Formula | C3Cl6F2 |
InChI | InChI=1S/C3Cl6F2/c4-2(5,6)1(10,11)3(7,8)9 |
InChIKey | YXVCODVAPNKSMC-UHFFFAOYSA-N |
Molecular Weight | 286.748 g/mol |
SMILES | C(Cl)(Cl)(Cl)C(F)(F)C(Cl)(Cl)Cl |
Spectrum/Structure Validation Score (Raman) | 0.86317 |