CID 345773

Nsc676729

Structural Information

Molecular Formula
C13H12N2
SMILES
CC1=CC=C(C=C1)N=CC2=CC=CC=N2
InChI
InChI=1S/C13H12N2/c1-11-5-7-12(8-6-11)15-10-13-4-2-3-9-14-13/h2-10H,1H3
InChIKey
LYPDXWBRSLBCSS-UHFFFAOYSA-N
Compound name
N-(4-methylphenyl)-1-pyridin-2-ylmethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

12
Patents

196.10005 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.10733 142.0
[M+Na]+ 219.08927 150.1
[M-H]- 195.09277 148.8
[M+NH4]+ 214.13387 160.4
[M+K]+ 235.06321 146.4
[M+H-H2O]+ 179.09731 133.7
[M+HCOO]- 241.09825 168.3
[M+CH3COO]- 255.11390 188.7
[M+Na-2H]- 217.07472 151.0
[M]+ 196.09950 142.0
[M]- 196.10060 142.0
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.