CID 137944173

2260931-16-4

Structural Information

Molecular Formula
C5H9F2N
SMILES
C1[C@H]([C@H]1C(F)F)CN
InChI
InChI=1S/C5H9F2N/c6-5(7)4-1-3(4)2-8/h3-5H,1-2,8H2/t3-,4-/m0/s1
InChIKey
PSQQHVRRDBJQHO-IMJSIDKUSA-N
Compound name
[(1R,2S)-2-(difluoromethyl)cyclopropyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

121.070305 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 122.07758 124.3
[M+Na]+ 144.05952 133.2
[M+NH4]+ 139.10413 131.9
[M+K]+ 160.03346 130.4
[M-H]- 120.06303 129.4
[M+Na-2H]- 142.04497 130.2
[M]+ 121.06976 127.6
[M]- 121.07085 127.6
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.