CID 5273894

Oprea1_195921

Structural Information

Molecular Formula
C19H22N2O3
SMILES
COC1=C(C=C(C=C1)C=NC2=CC=C(C=C2)N3CCOCC3)OC
InChI
InChI=1S/C19H22N2O3/c1-22-18-8-3-15(13-19(18)23-2)14-20-16-4-6-17(7-5-16)21-9-11-24-12-10-21/h3-8,13-14H,9-12H2,1-2H3
InChIKey
XGJZNCFLLPQSAX-UHFFFAOYSA-N
Compound name
1-(3,4-dimethoxyphenyl)-N-(4-morpholin-4-ylphenyl)methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

326.16306 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.17034 178.4
[M+Na]+ 349.15228 183.6
[M-H]- 325.15578 187.9
[M+NH4]+ 344.19688 189.5
[M+K]+ 365.12622 181.3
[M+H-H2O]+ 309.16032 167.5
[M+HCOO]- 371.16126 199.1
[M+CH3COO]- 385.17691 212.3
[M+Na-2H]- 347.13773 182.6
[M]+ 326.16251 179.0
[M]- 326.16361 179.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.