CID 95250

729-43-1

Structural Information

Molecular Formula
C16H16N2
SMILES
CC(=NN=C(C)C1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C16H16N2/c1-13(15-9-5-3-6-10-15)17-18-14(2)16-11-7-4-8-12-16/h3-12H,1-2H3
InChIKey
MOKMQSIJAHPSQX-UHFFFAOYSA-N
Compound name
1-phenyl-N-(1-phenylethylideneamino)ethanimine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

7
References

38
Patents

236.13135 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.13863 155.4
[M+Na]+ 259.12057 160.4
[M-H]- 235.12407 164.2
[M+NH4]+ 254.16517 173.2
[M+K]+ 275.09451 157.5
[M+H-H2O]+ 219.12861 146.7
[M+HCOO]- 281.12955 182.5
[M+CH3COO]- 295.14520 201.7
[M+Na-2H]- 257.10602 161.6
[M]+ 236.13080 154.6
[M]- 236.13190 154.6
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