CID 555698

N,1-diphenylethan-1-imine

Structural Information

Molecular Formula
C14H13N
SMILES
CC(=NC1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C14H13N/c1-12(13-8-4-2-5-9-13)15-14-10-6-3-7-11-14/h2-11H,1H3
InChIKey
CBXWICRJSHEQJT-UHFFFAOYSA-N
Compound name
N,1-diphenylethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

233
Patents

195.1048 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.11208 142.6
[M+Na]+ 218.09402 149.0
[M-H]- 194.09752 150.4
[M+NH4]+ 213.13862 161.9
[M+K]+ 234.06796 145.8
[M+H-H2O]+ 178.10206 135.1
[M+HCOO]- 240.10300 168.8
[M+CH3COO]- 254.11865 188.9
[M+Na-2H]- 216.07947 150.4
[M]+ 195.10425 141.5
[M]- 195.10535 141.5
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