CID 105453329

3,3-difluoro-1-(2-fluorophenyl)cyclobutan-1-amine hydrochloride

Structural Information

Molecular Formula
C10H10F3N
SMILES
C1C(CC1(F)F)(C2=CC=CC=C2F)N
InChI
InChI=1S/C10H10F3N/c11-8-4-2-1-3-7(8)9(14)5-10(12,13)6-9/h1-4H,5-6,14H2
InChIKey
LXZWBQVAXRDXHQ-UHFFFAOYSA-N
Compound name
3,3-difluoro-1-(2-fluorophenyl)cyclobutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

201.07654 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.083816 141.5
[M+Na]+ 224.065758 150.2
[M-H]- 200.069264 144.8
[M+NH4]+ 219.110363 157.9
[M+K]+ 240.039698 149.4
[M+H-H2O]+ 184.073800 129.7
[M+HCOO]- 246.074741 161.2
[M+CH3COO]- 260.090391 189.6
[M+Na-2H]- 222.051206 146.7
[M]+ 201.07599142 144.0
[M]- 201.07708858 144.0
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

No patent data available for this compound.