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

21
Patents

102.048096 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 103.05537 116.9
[M+Na]+ 125.03731 127.4
[M-H]- 101.04082 120.9
[M+NH4]+ 120.08192 137.1
[M+K]+ 141.01125 126.7
[M+H-H2O]+ 85.045356 111.8
[M+HCOO]- 147.04630 140.4
[M+CH3COO]- 161.06195 170.0
[M+Na-2H]- 123.02276 125.6
[M]+ 102.04755 118.9
[M]- 102.04864 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