CID 3613924

4'-(4-chlorobenzylideneamino)acetophenone

Structural Information

Molecular Formula
C15H12ClNO
SMILES
CC(=O)C1=CC=C(C=C1)N=CC2=CC=C(C=C2)Cl
InChI
InChI=1S/C15H12ClNO/c1-11(18)13-4-8-15(9-5-13)17-10-12-2-6-14(16)7-3-12/h2-10H,1H3
InChIKey
HBIOGMSFDFPLMI-UHFFFAOYSA-N
Compound name
1-[4-[(4-chlorophenyl)methylideneamino]phenyl]ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

257.06073 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.06801 156.7
[M+Na]+ 280.04995 172.7
[M+NH4]+ 275.09455 166.1
[M+K]+ 296.02389 163.3
[M-H]- 256.05345 162.5
[M+Na-2H]- 278.03540 167.1
[M]+ 257.06018 161.1
[M]- 257.06128 161.1
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

patents stripe