CID 9570788

72004-04-7

Structural Information

Molecular Formula
C22H28N4O3
SMILES
C/C(=N\OCC(=O)N(CCN1CCOCC1)C2=CC=CC=C2)/C3=CC=C(C=C3)N
InChI
InChI=1S/C22H28N4O3/c1-18(19-7-9-20(23)10-8-19)24-29-17-22(27)26(21-5-3-2-4-6-21)12-11-25-13-15-28-16-14-25/h2-10H,11-17,23H2,1H3/b24-18+
InChIKey
GXFQHWMQDIDQAK-HKOYGPOVSA-N
Compound name
2-[(E)-1-(4-aminophenyl)ethylideneamino]oxy-N-(2-morpholin-4-ylethyl)-N-phenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

396.21616 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 397.22344 197.4
[M+Na]+ 419.20538 197.4
[M-H]- 395.20888 206.4
[M+NH4]+ 414.24998 204.3
[M+K]+ 435.17932 196.1
[M+H-H2O]+ 379.21342 185.2
[M+HCOO]- 441.21436 217.2
[M+CH3COO]- 455.23001 232.2
[M+Na-2H]- 417.19083 198.8
[M]+ 396.21561 195.2
[M]- 396.21671 195.2
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.