CID 1250746

328263-30-5

Structural Information

Molecular Formula
C22H20N2O4
SMILES
COC1=C(C=CC(=C1)C=NCC2=CC=CC=C2)OCC3=CC=C(C=C3)[N+](=O)[O-]
InChI
InChI=1S/C22H20N2O4/c1-27-22-13-19(15-23-14-17-5-3-2-4-6-17)9-12-21(22)28-16-18-7-10-20(11-8-18)24(25)26/h2-13,15H,14,16H2,1H3
InChIKey
HWXWEMRACGTEPX-UHFFFAOYSA-N
Compound name
N-benzyl-1-[3-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

376.1423 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 377.14958 190.2
[M+Na]+ 399.13152 206.3
[M+NH4]+ 394.17612 197.8
[M+K]+ 415.10546 199.2
[M-H]- 375.13502 199.0
[M+Na-2H]- 397.11697 201.1
[M]+ 376.14175 195.0
[M]- 376.14285 195.0
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

No patent data available for this compound.