CID 150777

Brn 0885356

Structural Information

Molecular Formula

C₁₃H₁₇N₅

SMILES

CN(C)C1=NC(=NC(=N1)C2=CC=CC=C2)N(C)C

InChI

InChI=1S/C13H17N5/c1-17(2)12-14-11(10-8-6-5-7-9-10)15-13(16-12)18(3)4/h5-9H,1-4H3

InChIKey

URNJXVNCPBQNEU-UHFFFAOYSA-N

Compound name

2-N,2-N,4-N,4-N-tetramethyl-6-phenyl-1,3,5-triazine-2,4-diamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 13
Patents: 243.14839 Da
Monoisotopic Mass: 3.0
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]+	244.15567	155.5
[M+Na]+	266.13761	169.5
[M+NH4]+	261.18221	163.2
[M+K]+	282.11155	163.1
[M-H]-	242.14111	160.3
[M+Na-2H]-	264.12306	165.6
[M]+	243.14784	158.9
[M]-	243.14894	158.9

Literature stripe

literature stripe

Patent stripe

patents stripe