CID 146155601

2416229-29-1

Structural Information

Molecular Formula
C6H9F2NO2
SMILES
COC(=O)C1(CC1(F)F)CN
InChI
InChI=1S/C6H9F2NO2/c1-11-4(10)5(3-9)2-6(5,7)8/h2-3,9H2,1H3
InChIKey
PIDGRKZVOXEHIZ-UHFFFAOYSA-N
Compound name
methyl 1-(aminomethyl)-2,2-difluorocyclopropane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

165.06013 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.06741 136.2
[M+Na]+ 188.04935 144.7
[M+NH4]+ 183.09395 145.1
[M+K]+ 204.02329 139.4
[M-H]- 164.05285 140.6
[M+Na-2H]- 186.03480 143.8
[M]+ 165.05958 139.5
[M]- 165.06068 139.5
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.