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]+ 202.08382 141.5
[M+Na]+ 224.06576 150.2
[M-H]- 200.06926 144.8
[M+NH4]+ 219.11036 157.9
[M+K]+ 240.03970 149.4
[M+H-H2O]+ 184.07380 129.7
[M+HCOO]- 246.07474 161.2
[M+CH3COO]- 260.09039 189.6
[M+Na-2H]- 222.05121 146.7
[M]+ 201.07599 144.0
[M]- 201.07709 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.