| SpectraBase Spectrum ID |
LsfhkPp91XE |
| Name |
3-(.omega.-Chlorohexafluoropropyl)-5-methylphenol |
| Comments |
Note: The molecular formula of the structure shown is C10H7ClF6O - which differs from the formula reported for the mass spectrum (C12H9ClF6O2) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H9ClF6O2 |
| InChI |
InChI=1S/C10H7ClF6O/c1-5-2-6(4-7(18)3-5)8(12,13)9(14,15)10(11,16)17/h2-4,18H,1H3 |
| InChIKey |
YRRQRNRASKUHHL-UHFFFAOYSA-N |
| Molecular Weight |
292.608 g/mol |
| SMILES |
Oc1cc(cc(c1)C)C(C(C(Cl)(F)F)(F)F)(F)F |
| SPLASH |
splash10-001i-0009000000-4d7126d6058591589505 |
| Source of Spectrum |
SO-0-1369-9 |
| Wiley ID |
874140 |
