CID 499408

Trans-n-(2-pyridylmethylene)aniline

Structural Information

Molecular Formula
C12H10N2
SMILES
C1=CC=C(C=C1)N=CC2=CC=CC=N2
InChI
InChI=1S/C12H10N2/c1-2-6-11(7-3-1)14-10-12-8-4-5-9-13-12/h1-10H
InChIKey
CSGRSRYPHUABSU-UHFFFAOYSA-N
Compound name
N-phenyl-1-pyridin-2-ylmethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

161
Patents

182.0844 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.09168 137.4
[M+Na]+ 205.07362 144.9
[M-H]- 181.07712 143.9
[M+NH4]+ 200.11822 155.9
[M+K]+ 221.04756 141.4
[M+H-H2O]+ 165.08166 129.0
[M+HCOO]- 227.08260 163.9
[M+CH3COO]- 241.09825 151.0
[M+Na-2H]- 203.05907 147.6
[M]+ 182.08385 136.6
[M]- 182.08495 136.6
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