CID 155821238

2445786-64-9

Structural Information

Molecular Formula
C11H14F2O
SMILES
C1C(CC12CC3(C2)CC(C3)(F)F)C=O
InChI
InChI=1S/C11H14F2O/c12-11(13)6-10(7-11)4-9(5-10)1-8(2-9)3-14/h3,8H,1-2,4-7H2
InChIKey
HCHMYHAUFOSVKX-UHFFFAOYSA-N
Compound name
8,8-difluorodispiro[3.1.36.14]decane-2-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

200.10127 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.10855 134.5
[M+Na]+ 223.09049 139.8
[M-H]- 199.09399 140.1
[M+NH4]+ 218.13509 140.1
[M+K]+ 239.06443 143.6
[M+H-H2O]+ 183.09853 121.9
[M+HCOO]- 245.09947 147.7
[M+CH3COO]- 259.11512 209.6
[M+Na-2H]- 221.07594 139.5
[M]+ 200.10072 152.8
[M]- 200.10182 152.8
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

No patent data available for this compound.