CID 238777

N-(3,4-dimethoxybenzylidene)aniline

Structural Information

Molecular Formula
C15H15NO2
SMILES
COC1=C(C=C(C=C1)C=NC2=CC=CC=C2)OC
InChI
InChI=1S/C15H15NO2/c1-17-14-9-8-12(10-15(14)18-2)11-16-13-6-4-3-5-7-13/h3-11H,1-2H3
InChIKey
KCSFGCVDFUCOIJ-UHFFFAOYSA-N
Compound name
1-(3,4-dimethoxyphenyl)-N-phenylmethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.11028 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.11756 153.4
[M+Na]+ 264.09950 161.3
[M-H]- 240.10300 161.7
[M+NH4]+ 259.14410 171.4
[M+K]+ 280.07344 158.5
[M+H-H2O]+ 224.10754 145.3
[M+HCOO]- 286.10848 180.6
[M+CH3COO]- 300.12413 197.3
[M+Na-2H]- 262.08495 160.3
[M]+ 241.10973 156.8
[M]- 241.11083 156.8
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

patents stripe