CID 79515380

[2-fluoro-6-(pyrrolidin-1-yl)phenyl]methanamine

Structural Information

Molecular Formula
C11H15FN2
SMILES
C1CCN(C1)C2=C(C(=CC=C2)F)CN
InChI
InChI=1S/C11H15FN2/c12-10-4-3-5-11(9(10)8-13)14-6-1-2-7-14/h3-5H,1-2,6-8,13H2
InChIKey
BMYFCQXYAXKCBA-UHFFFAOYSA-N
Compound name
(2-fluoro-6-pyrrolidin-1-ylphenyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

194.12193 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.12921 141.7
[M+Na]+ 217.11115 148.6
[M-H]- 193.11465 145.2
[M+NH4]+ 212.15575 161.1
[M+K]+ 233.08509 145.0
[M+H-H2O]+ 177.11919 133.5
[M+HCOO]- 239.12013 163.1
[M+CH3COO]- 253.13578 185.3
[M+Na-2H]- 215.09660 144.3
[M]+ 194.12138 136.2
[M]- 194.12248 136.2
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