CID 50989645

2-fluoro-6-(pyrrolidin-1-yl)aniline

Structural Information

Molecular Formula
C10H13FN2
SMILES
C1CCN(C1)C2=C(C(=CC=C2)F)N
InChI
InChI=1S/C10H13FN2/c11-8-4-3-5-9(10(8)12)13-6-1-2-7-13/h3-5H,1-2,6-7,12H2
InChIKey
KVQQZPSWPXPGFE-UHFFFAOYSA-N
Compound name
2-fluoro-6-pyrrolidin-1-ylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

180.10628 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.11356 137.1
[M+Na]+ 203.09550 144.5
[M-H]- 179.09900 140.8
[M+NH4]+ 198.14010 157.1
[M+K]+ 219.06944 141.1
[M+H-H2O]+ 163.10354 129.1
[M+HCOO]- 225.10448 158.9
[M+CH3COO]- 239.12013 182.3
[M+Na-2H]- 201.08095 140.2
[M]+ 180.10573 131.2
[M]- 180.10683 131.2
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