CID 132343884

2137577-32-1

Structural Information

Molecular Formula
C5H6F2O
SMILES
C1[C@@H]([C@@H]1C(F)F)C=O
InChI
InChI=1S/C5H6F2O/c6-5(7)4-1-3(4)2-8/h2-5H,1H2/t3-,4-/m1/s1
InChIKey
FIHPBZMPGOPXPU-QWWZWVQMSA-N
Compound name
(1S,2R)-2-(difluoromethyl)cyclopropane-1-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

120.03867 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 121.04595 116.3
[M+Na]+ 143.02789 126.7
[M-H]- 119.03139 118.9
[M+NH4]+ 138.07249 134.0
[M+K]+ 159.00183 124.9
[M+H-H2O]+ 103.03593 109.3
[M+HCOO]- 165.03687 138.1
[M+CH3COO]- 179.05252 174.9
[M+Na-2H]- 141.01334 121.8
[M]+ 120.03812 116.5
[M]- 120.03922 116.5
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.