CID 18870855

N-(2-benzoyl-4-nitrophenyl)-4-morpholineacetamide

Structural Information

Molecular Formula
C19H19N3O5
SMILES
C1COCCN1CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C3
InChI
InChI=1S/C19H19N3O5/c23-18(13-21-8-10-27-11-9-21)20-17-7-6-15(22(25)26)12-16(17)19(24)14-4-2-1-3-5-14/h1-7,12H,8-11,13H2,(H,20,23)
InChIKey
UZNYYVDPHFMTBZ-UHFFFAOYSA-N
Compound name
N-(2-benzoyl-4-nitrophenyl)-2-morpholin-4-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

369.13248 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 370.13976 183.3
[M+Na]+ 392.12170 195.2
[M+NH4]+ 387.16630 188.8
[M+K]+ 408.09564 192.6
[M-H]- 368.12520 190.3
[M+Na-2H]- 390.10715 190.1
[M]+ 369.13193 186.6
[M]- 369.13303 186.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe