CID 525682

N-(4-chlorobenzylidene)-p-phenetidine

Structural Information

Molecular Formula
C15H14ClNO
SMILES
CCOC1=CC=C(C=C1)N=CC2=CC=C(C=C2)Cl
InChI
InChI=1S/C15H14ClNO/c1-2-18-15-9-7-14(8-10-15)17-11-12-3-5-13(16)6-4-12/h3-11H,2H2,1H3
InChIKey
VZUYGOJTZOHTOE-UHFFFAOYSA-N
Compound name
1-(4-chlorophenyl)-N-(4-ethoxyphenyl)methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

259.0764 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.08368 157.5
[M+Na]+ 282.06562 166.3
[M-H]- 258.06912 165.5
[M+NH4]+ 277.11022 175.7
[M+K]+ 298.03956 161.1
[M+H-H2O]+ 242.07366 150.3
[M+HCOO]- 304.07460 179.9
[M+CH3COO]- 318.09025 199.0
[M+Na-2H]- 280.05107 163.8
[M]+ 259.07585 161.7
[M]- 259.07695 161.7
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.