CID 671267

N-(3-acetylphenyl)morpholine-4-carboxamide

Structural Information

Molecular Formula
C13H16N2O3
SMILES
CC(=O)C1=CC(=CC=C1)NC(=O)N2CCOCC2
InChI
InChI=1S/C13H16N2O3/c1-10(16)11-3-2-4-12(9-11)14-13(17)15-5-7-18-8-6-15/h2-4,9H,5-8H2,1H3,(H,14,17)
InChIKey
GFGGXIIHWJXKMZ-UHFFFAOYSA-N
Compound name
N-(3-acetylphenyl)morpholine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

0
Patents

248.11609 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.12337 156.7
[M+Na]+ 271.10531 160.8
[M-H]- 247.10881 161.8
[M+NH4]+ 266.14991 170.2
[M+K]+ 287.07925 160.0
[M+H-H2O]+ 231.11335 148.2
[M+HCOO]- 293.11429 174.9
[M+CH3COO]- 307.12994 193.8
[M+Na-2H]- 269.09076 160.4
[M]+ 248.11554 153.4
[M]- 248.11664 153.4
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

No patent data available for this compound.