CID 23532969

494210-62-7

Structural Information

Molecular Formula
C7H8F2O
SMILES
C1C(CC2C1C2(F)F)C=O
InChI
InChI=1S/C7H8F2O/c8-7(9)5-1-4(3-10)2-6(5)7/h3-6H,1-2H2
InChIKey
FDNVNXMDRNDLMG-UHFFFAOYSA-N
Compound name
6,6-difluorobicyclo[3.1.0]hexane-3-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

146.05432 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.061596 123.7
[M+Na]+ 169.043538 135.6
[M-H]- 145.047044 127.2
[M+NH4]+ 164.088143 145.1
[M+K]+ 185.017478 132.8
[M+H-H2O]+ 129.051580 118.3
[M+HCOO]- 191.052521 144.3
[M+CH3COO]- 205.068171 178.2
[M+Na-2H]- 167.028986 129.5
[M]+ 146.05377142 124.2
[M]- 146.05486858 124.2
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