CID 441083

N-isopropylammelide

Structural Information

Molecular Formula

C₆H₁₀N₄O₂

SMILES

CC(C)NC1=NC(=O)NC(=O)N1

InChI

InChI=1S/C6H10N4O2/c1-3(2)7-4-8-5(11)10-6(12)9-4/h3H,1-2H3,(H3,7,8,9,10,11,12)

InChIKey

DBFMBHXVWIURSV-UHFFFAOYSA-N

Compound name

6-(propan-2-ylamino)-1H-1,3,5-triazine-2,4-dione

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 6
References: 101
Patents: 170.08037 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]+	171.08765	134.1
[M+Na]+	193.06959	145.0
[M+NH4]+	188.11419	139.2
[M+K]+	209.04353	141.6
[M-H]-	169.07309	132.5
[M+Na-2H]-	191.05504	138.6
[M]+	170.07982	134.7
[M]-	170.08092	134.7

Literature stripe

literature stripe

Patent stripe

patents stripe