CID 9575011

36772-40-4

Structural Information

Molecular Formula
C12H11N5
SMILES
C1=CC=NC(=C1)/C=N/N=C(/C2=CC=CC=N2)\N
InChI
InChI=1S/C12H11N5/c13-12(11-6-2-4-8-15-11)17-16-9-10-5-1-3-7-14-10/h1-9H,(H2,13,17)/b16-9+
InChIKey
RSFAFOBXOXFBID-CXUHLZMHSA-N
Compound name
N'-[(E)-pyridin-2-ylmethylideneamino]pyridine-2-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

225.10144 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.10872 148.6
[M+Na]+ 248.09066 154.9
[M-H]- 224.09416 154.6
[M+NH4]+ 243.13526 163.6
[M+K]+ 264.06460 151.5
[M+H-H2O]+ 208.09870 138.3
[M+HCOO]- 270.09964 175.9
[M+CH3COO]- 284.11529 198.5
[M+Na-2H]- 246.07611 158.2
[M]+ 225.10089 146.4
[M]- 225.10199 146.4
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.