CID 97127

Nsc101545

Structural Information

Molecular Formula
C15H11N3
SMILES
C1=CC=C2C(=C1)C=C(C=N2)N=CC3=CN=CC=C3
InChI
InChI=1S/C15H11N3/c1-2-6-15-13(5-1)8-14(11-18-15)17-10-12-4-3-7-16-9-12/h1-11H
InChIKey
VVWMGEZLUIGLMJ-UHFFFAOYSA-N
Compound name
1-pyridin-3-yl-N-quinolin-3-ylmethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

233.09529 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.10257 152.0
[M+Na]+ 256.08451 169.1
[M+NH4]+ 251.12911 161.7
[M+K]+ 272.05845 159.1
[M-H]- 232.08801 158.1
[M+Na-2H]- 254.06996 164.0
[M]+ 233.09474 156.4
[M]- 233.09584 156.4
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.