CID 43148299

3-amino-2-[(4-fluorophenyl)methyl]propanamide

Structural Information

Molecular Formula
C10H13FN2O
SMILES
C1=CC(=CC=C1CC(CN)C(=O)N)F
InChI
InChI=1S/C10H13FN2O/c11-9-3-1-7(2-4-9)5-8(6-12)10(13)14/h1-4,8H,5-6,12H2,(H2,13,14)
InChIKey
AOVNHZKZKPEZEX-UHFFFAOYSA-N
Compound name
2-(aminomethyl)-3-(4-fluorophenyl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

196.1012 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.10848 142.4
[M+Na]+ 219.09042 151.3
[M+NH4]+ 214.13502 149.2
[M+K]+ 235.06436 146.5
[M-H]- 195.09392 143.2
[M+Na-2H]- 217.07587 147.0
[M]+ 196.10065 143.4
[M]- 196.10175 143.4
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.