CID 54310337

1018434-72-4

Structural Information

Molecular Formula
C3H7F2N
SMILES
CC(C(F)F)N
InChI
InChI=1S/C3H7F2N/c1-2(6)3(4)5/h2-3H,6H2,1H3
InChIKey
SKKXZAXLYWERGC-UHFFFAOYSA-N
Compound name
1,1-difluoropropan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

190
Patents

95.05466 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 96.061936 115.2
[M+Na]+ 118.04388 122.4
[M-H]- 94.047384 112.8
[M+NH4]+ 113.08848 138.0
[M+K]+ 134.01782 122.7
[M+H-H2O]+ 78.051920 109.2
[M+HCOO]- 140.05286 136.2
[M+CH3COO]- 154.06851 169.4
[M+Na-2H]- 116.02933 119.3
[M]+ 95.054111 109.7
[M]- 95.055209 109.7
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