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

3
Patents

121.070305 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 122.07758 117.2
[M+Na]+ 144.05952 127.4
[M-H]- 120.06303 120.0
[M+NH4]+ 139.10413 136.6
[M+K]+ 160.03346 126.1
[M+H-H2O]+ 104.06756 111.2
[M+HCOO]- 166.06851 140.3
[M+CH3COO]- 180.08416 177.1
[M+Na-2H]- 142.04497 125.2
[M]+ 121.06976 117.0
[M]- 121.07085 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