CID 72218488

2098064-73-2

Structural Information

Molecular Formula
C5H9F2N
SMILES
CNCC1CC1(F)F
InChI
InChI=1S/C5H9F2N/c1-8-3-4-2-5(4,6)7/h4,8H,2-3H2,1H3
InChIKey
YOIMBYWXZGMQKT-UHFFFAOYSA-N
Compound name
1-(2,2-difluorocyclopropyl)-N-methylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

121.070305 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 122.077581 117.2
[M+Na]+ 144.059523 127.4
[M-H]- 120.063029 120.0
[M+NH4]+ 139.104128 136.6
[M+K]+ 160.033463 126.1
[M+H-H2O]+ 104.067565 111.2
[M+HCOO]- 166.068506 140.3
[M+CH3COO]- 180.084156 177.1
[M+Na-2H]- 142.044971 125.2
[M]+ 121.06975642 117.0
[M]- 121.07085358 117.0
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