CID 11469186

13452-82-9

Structural Information

Molecular Formula

C₅H₁₀N₆

SMILES

CNC1=NC(=NC(=N1)N)NC

InChI

InChI=1S/C5H10N6/c1-7-4-9-3(6)10-5(8-2)11-4/h1-2H3,(H4,6,7,8,9,10,11)

InChIKey

CHOSFPFCXKKOHO-UHFFFAOYSA-N

Compound name

2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 143
Patents: 154.0967 Da
Monoisotopic Mass: 0.3
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]+	155.10398	132.0
[M+Na]+	177.08592	140.7
[M-H]-	153.08942	132.1
[M+NH4]+	172.13052	148.4
[M+K]+	193.05986	138.6
[M+H-H2O]+	137.09396	123.8
[M+HCOO]-	199.09490	156.4
[M+CH3COO]-	213.11055	184.1
[M+Na-2H]-	175.07137	141.1
[M]+	154.09615	129.6
[M]-	154.09725	129.6

Literature stripe

literature stripe

Patent stripe

patents stripe