CID 3060181

N-allyl-2'-benzoyl-4'-nitro-2-morpholinoacetanilide maleate

Structural Information

Molecular Formula
C22H23N3O5
SMILES
C=CCN(C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)C2=CC=CC=C2)C(=O)CN3CCOCC3
InChI
InChI=1S/C22H23N3O5/c1-2-10-24(21(26)16-23-11-13-30-14-12-23)20-9-8-18(25(28)29)15-19(20)22(27)17-6-4-3-5-7-17/h2-9,15H,1,10-14,16H2
InChIKey
FHLVXXCKMFGEDQ-UHFFFAOYSA-N
Compound name
N-(2-benzoyl-4-nitrophenyl)-2-morpholin-4-yl-N-prop-2-enylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

409.16376 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 410.17104 193.9
[M+Na]+ 432.15298 205.4
[M+NH4]+ 427.19758 198.8
[M+K]+ 448.12692 202.6
[M-H]- 408.15648 200.8
[M+Na-2H]- 430.13843 200.2
[M]+ 409.16321 197.0
[M]- 409.16431 197.0
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