CID 3057066

S-triazine, 2-amino-4-anilino-, hydrochloride

Structural Information

Molecular Formula

C₃H₆N₆

SMILES

C1=NC(=NC(=N1)NN)N

InChI

InChI=1S/C3H6N6/c4-2-6-1-7-3(8-2)9-5/h1H,5H2,(H3,4,6,7,8,9)

InChIKey

NOTYRPPWMLDEIO-UHFFFAOYSA-N

Compound name

4-hydrazinyl-1,3,5-triazin-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 7
Patents: 126.06539 Da
Monoisotopic Mass: -0.8
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]+	127.07267	122.1
[M+Na]+	149.05461	130.8
[M-H]-	125.05811	121.6
[M+NH4]+	144.09921	139.0
[M+K]+	165.02855	128.8
[M+H-H2O]+	109.06265	114.1
[M+HCOO]-	171.06359	146.6
[M+CH3COO]-	185.07924	176.2
[M+Na-2H]-	147.04006	132.1
[M]+	126.06484	117.7
[M]-	126.06594	117.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe