CID 835134

Benzamide, 4-fluoro-n-(2-(4-morpholinyl)ethyl)-

Structural Information

Molecular Formula
C13H17FN2O2
SMILES
C1COCCN1CCNC(=O)C2=CC=C(C=C2)F
InChI
InChI=1S/C13H17FN2O2/c14-12-3-1-11(2-4-12)13(17)15-5-6-16-7-9-18-10-8-16/h1-4H,5-10H2,(H,15,17)
InChIKey
NOMMINDFYOPRPU-UHFFFAOYSA-N
Compound name
4-fluoro-N-(2-morpholin-4-ylethyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

14
Patents

252.12741 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.13469 157.5
[M+Na]+ 275.11663 161.6
[M-H]- 251.12013 161.0
[M+NH4]+ 270.16123 170.9
[M+K]+ 291.09057 159.8
[M+H-H2O]+ 235.12467 147.9
[M+HCOO]- 297.12561 175.2
[M+CH3COO]- 311.14126 194.8
[M+Na-2H]- 273.10208 161.7
[M]+ 252.12686 153.0
[M]- 252.12796 153.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe