CID 2758304

Difluoromethyldimethylamine

Structural Information

Molecular Formula
C3H7F2N
SMILES
CN(C)C(F)F
InChI
InChI=1S/C3H7F2N/c1-6(2)3(4)5/h3H,1-2H3
InChIKey
PULPCFLUVFWKAF-UHFFFAOYSA-N
Compound name
1,1-difluoro-N,N-dimethylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

101
Patents

95.05466 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 96.061936 113.9
[M+Na]+ 118.04388 121.5
[M-H]- 94.047384 113.5
[M+NH4]+ 113.08848 137.7
[M+K]+ 134.01782 123.1
[M+H-H2O]+ 78.051920 107.7
[M+HCOO]- 140.05286 137.1
[M+CH3COO]- 154.06851 172.9
[M+Na-2H]- 116.02933 119.7
[M]+ 95.054111 111.4
[M]- 95.055209 111.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe