CID 9574313

[1-aza-2-(2,4-dimethylphenyl)vinyl](imino-4-pyridylmethyl)amine

Structural Information

Molecular Formula
C15H16N4
SMILES
CC1=CC(=C(C=C1)/C=N/N=C(/C2=CC=NC=C2)\N)C
InChI
InChI=1S/C15H16N4/c1-11-3-4-14(12(2)9-11)10-18-19-15(16)13-5-7-17-8-6-13/h3-10H,1-2H3,(H2,16,19)/b18-10+
InChIKey
YKFTZCYQMWFUJJ-VCHYOVAHSA-N
Compound name
N'-[(E)-(2,4-dimethylphenyl)methylideneamino]pyridine-4-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

252.1375 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.14478 159.2
[M+Na]+ 275.12672 166.1
[M-H]- 251.13022 166.9
[M+NH4]+ 270.17132 175.2
[M+K]+ 291.10066 162.3
[M+H-H2O]+ 235.13476 149.7
[M+HCOO]- 297.13570 186.8
[M+CH3COO]- 311.15135 207.1
[M+Na-2H]- 273.11217 165.3
[M]+ 252.13695 158.4
[M]- 252.13805 158.4
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

No patent data available for this compound.