CID 31995

N-p-tolylisonicotinamidine

Structural Information

Molecular Formula

C₁₃H₁₃N₃

SMILES

CC1=CC=C(C=C1)N=C(C2=CC=NC=C2)N

InChI

InChI=1S/C13H13N3/c1-10-2-4-12(5-3-10)16-13(14)11-6-8-15-9-7-11/h2-9H,1H3,(H2,14,16)

InChIKey

ANXBBENPWKWPST-UHFFFAOYSA-N

Compound name

N'-(4-methylphenyl)pyridine-4-carboximidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 211.11095 Da
Monoisotopic Mass: 1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	212.11823	147.9
[M+Na]+	234.10017	161.6
[M+NH4]+	229.14477	156.6
[M+K]+	250.07411	153.9
[M-H]-	210.10367	153.6
[M+Na-2H]-	232.08562	158.2
[M]+	211.11040	151.4
[M]-	211.11150	151.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe