CID 55284166

2,2-difluorocyclopropane-1-carboxamide

Structural Information

Molecular Formula
C4H5F2NO
SMILES
C1C(C1(F)F)C(=O)N
InChI
InChI=1S/C4H5F2NO/c5-4(6)1-2(4)3(7)8/h2H,1H2,(H2,7,8)
InChIKey
VEQGOZCVNSMHRR-UHFFFAOYSA-N
Compound name
2,2-difluorocyclopropane-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

151
Patents

121.03392 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 122.041196 115.4
[M+Na]+ 144.023138 126.1
[M-H]- 120.026644 118.0
[M+NH4]+ 139.067743 134.4
[M+K]+ 159.997078 124.7
[M+H-H2O]+ 104.031180 109.8
[M+HCOO]- 166.032121 137.6
[M+CH3COO]- 180.047771 175.4
[M+Na-2H]- 142.008586 121.7
[M]+ 121.03337142 114.1
[M]- 121.03446858 114.1
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