CID 11745212

1063734-58-6

Structural Information

Molecular Formula
C11H14FN
SMILES
C1C[C@@H]([C@@H](C1)N)C2=CC=C(C=C2)F
InChI
InChI=1S/C11H14FN/c12-9-6-4-8(5-7-9)10-2-1-3-11(10)13/h4-7,10-11H,1-3,13H2/t10-,11-/m1/s1
InChIKey
SBIOJANZHQTSRP-GHMZBOCLSA-N
Compound name
cis-(1R,2R)-2-(4-fluorophenyl)cyclopentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

179.11102 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.118296 137.4
[M+Na]+ 202.100238 144.3
[M-H]- 178.103744 142.3
[M+NH4]+ 197.144843 158.8
[M+K]+ 218.074178 140.8
[M+H-H2O]+ 162.108280 130.4
[M+HCOO]- 224.109221 160.1
[M+CH3COO]- 238.124871 182.7
[M+Na-2H]- 200.085686 140.0
[M]+ 179.11047142 131.3
[M]- 179.11156858 131.3
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

patents stripe