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

5
Patents

146.05432 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.06160 123.7
[M+Na]+ 169.04354 135.6
[M-H]- 145.04704 127.2
[M+NH4]+ 164.08814 145.1
[M+K]+ 185.01748 132.8
[M+H-H2O]+ 129.05158 118.3
[M+HCOO]- 191.05252 144.3
[M+CH3COO]- 205.06817 178.2
[M+Na-2H]- 167.02899 129.5
[M]+ 146.05377 124.2
[M]- 146.05487 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