CID 138040138

2247106-78-9

Structural Information

Molecular Formula
C8H11F2N3
SMILES
C1C(CC1(F)F)(CN2C=CN=C2)N
InChI
InChI=1S/C8H11F2N3/c9-8(10)3-7(11,4-8)5-13-2-1-12-6-13/h1-2,6H,3-5,11H2
InChIKey
RICNYLZWYOQACU-UHFFFAOYSA-N
Compound name
3,3-difluoro-1-(imidazol-1-ylmethyl)cyclobutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.0921 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.09938 137.1
[M+Na]+ 210.08132 145.0
[M-H]- 186.08482 138.8
[M+NH4]+ 205.12592 152.8
[M+K]+ 226.05526 145.2
[M+H-H2O]+ 170.08936 124.8
[M+HCOO]- 232.09030 156.7
[M+CH3COO]- 246.10595 185.2
[M+Na-2H]- 208.06677 142.4
[M]+ 187.09155 141.3
[M]- 187.09265 141.3
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.