CID 53302262

1-(fluoromethyl)cyclopropane-1-carbaldehyde

Structural Information

Molecular Formula
C5H7FO
SMILES
C1CC1(CF)C=O
InChI
InChI=1S/C5H7FO/c6-3-5(4-7)1-2-5/h4H,1-3H2
InChIKey
VVSXPZDSMOTRMF-UHFFFAOYSA-N
Compound name
1-(fluoromethyl)cyclopropane-1-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

102.048096 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 103.055372 116.9
[M+Na]+ 125.037314 127.4
[M-H]- 101.040820 120.9
[M+NH4]+ 120.081919 137.1
[M+K]+ 141.011254 126.7
[M+H-H2O]+ 85.045356 111.8
[M+HCOO]- 147.046297 140.4
[M+CH3COO]- 161.061947 170.0
[M+Na-2H]- 123.022762 125.6
[M]+ 102.04754742 118.9
[M]- 102.04864458 118.9
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