CID 55294050

2-cyclopropyl-1-(5-fluoropyridin-3-yl)ethan-1-amine dihydrochloride

Structural Information

Molecular Formula
C10H13FN2
SMILES
C1CC1CC(C2=CC(=CN=C2)F)N
InChI
InChI=1S/C10H13FN2/c11-9-4-8(5-13-6-9)10(12)3-7-1-2-7/h4-7,10H,1-3,12H2
InChIKey
OHDQSIBTBGSYMW-UHFFFAOYSA-N
Compound name
2-cyclopropyl-1-(5-fluoropyridin-3-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

180.10628 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.11356 136.3
[M+Na]+ 203.09550 145.1
[M-H]- 179.09900 140.8
[M+NH4]+ 198.14010 149.7
[M+K]+ 219.06944 141.3
[M+H-H2O]+ 163.10354 128.0
[M+HCOO]- 225.10448 158.4
[M+CH3COO]- 239.12013 187.4
[M+Na-2H]- 201.08095 141.5
[M]+ 180.10573 135.2
[M]- 180.10683 135.2
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

No patent data available for this compound.