CID 306191

32894-80-7

Structural Information

Molecular Formula
C15H12ClN
SMILES
C1=CC=C(C=C1)C=CC=NC2=CC(=CC=C2)Cl
InChI
InChI=1S/C15H12ClN/c16-14-9-4-10-15(12-14)17-11-5-8-13-6-2-1-3-7-13/h1-12H
InChIKey
KAWRHCVFQIILQA-UHFFFAOYSA-N
Compound name
N-(3-chlorophenyl)-3-phenylprop-2-en-1-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.06583 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.07311 153.6
[M+Na]+ 264.05505 162.0
[M-H]- 240.05855 161.2
[M+NH4]+ 259.09965 172.3
[M+K]+ 280.02899 155.5
[M+H-H2O]+ 224.06309 146.5
[M+HCOO]- 286.06403 176.0
[M+CH3COO]- 300.07968 194.4
[M+Na-2H]- 262.04050 160.7
[M]+ 241.06528 155.2
[M]- 241.06638 155.2
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.