CID 74485

Decafluorobenzhydrol

Structural Information

Molecular Formula
C13H2F10O
SMILES
C1(=C(C(=C(C(=C1F)F)F)F)F)C(C2=C(C(=C(C(=C2F)F)F)F)F)O
InChI
InChI=1S/C13H2F10O/c14-3-1(4(15)8(19)11(22)7(3)18)13(24)2-5(16)9(20)12(23)10(21)6(2)17/h13,24H
InChIKey
WRLLBTKDSCJOBL-UHFFFAOYSA-N
Compound name
bis(2,3,4,5,6-pentafluorophenyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

404
Patents

363.9946 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.00188 185.9
[M+Na]+ 386.98382 188.6
[M+NH4]+ 382.02842 185.7
[M+K]+ 402.95776 185.2
[M-H]- 362.98732 180.7
[M+Na-2H]- 384.96927 184.3
[M]+ 363.99405 184.5
[M]- 363.99515 184.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe