CID 3018656

76418-49-0

Structural Information

Molecular Formula
C16H18N4
SMILES
CC1=NC(=CC=C1)C=NCCN=CC2=CC=CC(=N2)C
InChI
InChI=1S/C16H18N4/c1-13-5-3-7-15(19-13)11-17-9-10-18-12-16-8-4-6-14(2)20-16/h3-8,11-12H,9-10H2,1-2H3
InChIKey
NCCJTKNIPMUERV-UHFFFAOYSA-N
Compound name
1-(6-methyl-2-pyridinyl)-N-[2-[(6-methyl-2-pyridinyl)methylideneamino]ethyl]methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

1
Patents

266.15314 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.160416 163.7
[M+Na]+ 289.142358 171.2
[M-H]- 265.145864 170.1
[M+NH4]+ 284.186963 178.3
[M+K]+ 305.116298 166.7
[M+H-H2O]+ 249.150400 153.2
[M+HCOO]- 311.151341 190.2
[M+CH3COO]- 325.166991 207.6
[M+Na-2H]- 287.127806 171.2
[M]+ 266.15259142 166.0
[M]- 266.15368858 166.0
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