CID 6434421

Brn 1232907

Structural Information

Molecular Formula
C24H28N4O4
SMILES
CC(=O)NC1=CC=C(C=C1)C(=O)N/C(=C/C2=CC=C(C=C2)N(C)C)/C(=O)N3CCOCC3
InChI
InChI=1S/C24H28N4O4/c1-17(29)25-20-8-6-19(7-9-20)23(30)26-22(24(31)28-12-14-32-15-13-28)16-18-4-10-21(11-5-18)27(2)3/h4-11,16H,12-15H2,1-3H3,(H,25,29)(H,26,30)/b22-16+
InChIKey
SMSOUILAYCVAAH-CJLVFECKSA-N
Compound name
4-acetamido-N-[(E)-1-[4-(dimethylamino)phenyl]-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

436.21106 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 437.21834 205.3
[M+Na]+ 459.20028 213.3
[M+NH4]+ 454.24488 209.0
[M+K]+ 475.17422 209.4
[M-H]- 435.20378 211.0
[M+Na-2H]- 457.18573 210.3
[M]+ 436.21051 207.5
[M]- 436.21161 207.5
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

No patent data available for this compound.