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-fluoro-3-pyridinyl)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]+ 181.113556 136.3
[M+Na]+ 203.095498 145.1
[M-H]- 179.099004 140.8
[M+NH4]+ 198.140103 149.7
[M+K]+ 219.069438 141.3
[M+H-H2O]+ 163.103540 128.0
[M+HCOO]- 225.104481 158.4
[M+CH3COO]- 239.120131 187.4
[M+Na-2H]- 201.080946 141.5
[M]+ 180.10573142 135.2
[M]- 180.10682858 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.