CID 6479572

Brn 4303815

Structural Information

Molecular Formula
C20H21N3O3
SMILES
C1COCCN1CC(=O)N/N=C/C(=O)C2=CC=C(C=C2)C3=CC=CC=C3
InChI
InChI=1S/C20H21N3O3/c24-19(14-21-22-20(25)15-23-10-12-26-13-11-23)18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-9,14H,10-13,15H2,(H,22,25)/b21-14+
InChIKey
RNWREFZELASIBH-KGENOOAVSA-N
Compound name
2-morpholin-4-yl-N-[(E)-[2-oxo-2-(4-phenylphenyl)ethylidene]amino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

351.1583 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 352.16558 183.9
[M+Na]+ 374.14752 185.8
[M-H]- 350.15102 192.5
[M+NH4]+ 369.19212 192.6
[M+K]+ 390.12146 183.1
[M+H-H2O]+ 334.15556 172.5
[M+HCOO]- 396.15650 203.6
[M+CH3COO]- 410.17215 217.7
[M+Na-2H]- 372.13297 187.4
[M]+ 351.15775 180.7
[M]- 351.15885 180.7
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.