CID 16781979

4-amino-n-[2-(morpholin-4-yl)ethyl]benzamide

Structural Information

Molecular Formula
C13H19N3O2
SMILES
C1COCCN1CCNC(=O)C2=CC=C(C=C2)N
InChI
InChI=1S/C13H19N3O2/c14-12-3-1-11(2-4-12)13(17)15-5-6-16-7-9-18-10-8-16/h1-4H,5-10,14H2,(H,15,17)
InChIKey
OBTQKZSCIDELLN-UHFFFAOYSA-N
Compound name
4-amino-N-(2-morpholin-4-ylethyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

82
Patents

249.14772 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.154996 158.6
[M+Na]+ 272.136938 161.8
[M-H]- 248.140444 162.9
[M+NH4]+ 267.181543 171.6
[M+K]+ 288.110878 160.1
[M+H-H2O]+ 232.144980 149.6
[M+HCOO]- 294.145921 177.8
[M+CH3COO]- 308.161571 196.7
[M+Na-2H]- 270.122386 162.8
[M]+ 249.14717142 153.6
[M]- 249.14826858 153.6
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