CID 65659

Befol

Structural Information

Molecular Formula
C14H19ClN2O2
SMILES
C1COCCN1CCCNC(=O)C2=CC=C(C=C2)Cl
InChI
InChI=1S/C14H19ClN2O2/c15-13-4-2-12(3-5-13)14(18)16-6-1-7-17-8-10-19-11-9-17/h2-5H,1,6-11H2,(H,16,18)
InChIKey
YYFGRAGNYHYWEZ-UHFFFAOYSA-N
Compound name
4-chloro-N-(3-morpholin-4-ylpropyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

27
References

900
Patents

282.1135 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.12078 165.2
[M+Na]+ 305.10272 177.2
[M+NH4]+ 300.14732 172.9
[M+K]+ 321.07666 170.0
[M-H]- 281.10622 170.0
[M+Na-2H]- 303.08817 171.3
[M]+ 282.11295 168.4
[M]- 282.11405 168.4
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