CID 2782563

(perfluorocyclohexyl)methanol

Structural Information

Molecular Formula
C7H3F11O
SMILES
C(C1(C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(F)F)F)O
InChI
InChI=1S/C7H3F11O/c8-2(1-19)3(9,10)5(13,14)7(17,18)6(15,16)4(2,11)12/h19H,1H2
InChIKey
ZFHKTQUHJNUDNH-UHFFFAOYSA-N
Compound name
(1,2,2,3,3,4,4,5,5,6,6-undecafluorocyclohexyl)methanol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

171
Patents

312.00082 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.00810 137.3
[M+Na]+ 334.99004 152.9
[M-H]- 310.99354 129.4
[M+NH4]+ 330.03464 162.5
[M+K]+ 350.96398 149.5
[M+H-H2O]+ 294.99808 129.8
[M+HCOO]- 356.99902 145.5
[M+CH3COO]- 371.01467 203.6
[M+Na-2H]- 332.97549 142.0
[M]+ 312.00027 123.7
[M]- 312.00137 123.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe