CID 462449

1-phenyl-n-(3-quinolyl)methanimine

Structural Information

Molecular Formula
C16H12N2
SMILES
C1=CC=C(C=C1)C=NC2=CC3=CC=CC=C3N=C2
InChI
InChI=1S/C16H12N2/c1-2-6-13(7-3-1)11-17-15-10-14-8-4-5-9-16(14)18-12-15/h1-12H
InChIKey
XMIXITQFVTZGLK-UHFFFAOYSA-N
Compound name
1-phenyl-N-quinolin-3-ylmethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

232.10005 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.10733 150.7
[M+Na]+ 255.08927 158.8
[M-H]- 231.09277 158.0
[M+NH4]+ 250.13387 168.2
[M+K]+ 271.06321 153.5
[M+H-H2O]+ 215.09731 141.5
[M+HCOO]- 277.09825 175.6
[M+CH3COO]- 291.11390 163.5
[M+Na-2H]- 253.07472 161.1
[M]+ 232.09950 150.3
[M]- 232.10060 150.3
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.