CID 218262

N-(2,5-dimethoxyphenyl)nicotinamidine

Structural Information

Molecular Formula
C14H15N3O2
SMILES
COC1=CC(=C(C=C1)OC)N=C(C2=CN=CC=C2)N
InChI
InChI=1S/C14H15N3O2/c1-18-11-5-6-13(19-2)12(8-11)17-14(15)10-4-3-7-16-9-10/h3-9H,1-2H3,(H2,15,17)
InChIKey
LNYNJGJBBCRQEM-UHFFFAOYSA-N
Compound name
N'-(2,5-dimethoxyphenyl)pyridine-3-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

257.11642 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.12370 158.1
[M+Na]+ 280.10564 165.2
[M-H]- 256.10914 164.6
[M+NH4]+ 275.15024 173.3
[M+K]+ 296.07958 162.6
[M+H-H2O]+ 240.11368 148.9
[M+HCOO]- 302.11462 183.7
[M+CH3COO]- 316.13027 202.2
[M+Na-2H]- 278.09109 163.8
[M]+ 257.11587 159.3
[M]- 257.11697 159.3
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.