CID 2437295

2-cyano-n-[4-(morpholin-4-yl)phenyl]acetamide

Structural Information

Molecular Formula
C13H15N3O2
SMILES
C1COCCN1C2=CC=C(C=C2)NC(=O)CC#N
InChI
InChI=1S/C13H15N3O2/c14-6-5-13(17)15-11-1-3-12(4-2-11)16-7-9-18-10-8-16/h1-4H,5,7-10H2,(H,15,17)
InChIKey
ZHVLIQVUAGHPCA-UHFFFAOYSA-N
Compound name
2-cyano-N-(4-morpholin-4-ylphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

245.11642 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 246.12370 155.1
[M+Na]+ 268.10564 161.6
[M-H]- 244.10914 158.6
[M+NH4]+ 263.15024 167.1
[M+K]+ 284.07958 158.5
[M+H-H2O]+ 228.11368 139.9
[M+HCOO]- 290.11462 170.5
[M+CH3COO]- 304.13027 204.4
[M+Na-2H]- 266.09109 159.5
[M]+ 245.11587 146.7
[M]- 245.11697 146.7
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

No patent data available for this compound.