CID 211773

Nicotinamidine, n-(p-methoxyphenyl)-

Structural Information

Molecular Formula
C13H13N3O
SMILES
COC1=CC=C(C=C1)N=C(C2=CN=CC=C2)N
InChI
InChI=1S/C13H13N3O/c1-17-12-6-4-11(5-7-12)16-13(14)10-3-2-8-15-9-10/h2-9H,1H3,(H2,14,16)
InChIKey
MIPYICLDBPZDHE-UHFFFAOYSA-N
Compound name
N'-(4-methoxyphenyl)pyridine-3-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

227.10587 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.113146 150.1
[M+Na]+ 250.095088 156.9
[M-H]- 226.098594 156.4
[M+NH4]+ 245.139693 166.4
[M+K]+ 266.069028 153.8
[M+H-H2O]+ 210.103130 141.2
[M+HCOO]- 272.104071 175.9
[M+CH3COO]- 286.119721 195.9
[M+Na-2H]- 248.080536 157.2
[M]+ 227.10532142 149.2
[M]- 227.10641858 149.2
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

patents stripe