CID 97122

2854-88-8

Structural Information

Molecular Formula

C₅H₆Cl₂N₄O

SMILES

CN(C1=NC(=NC(=N1)Cl)Cl)OC

InChI

InChI=1S/C5H6Cl2N4O/c1-11(12-2)5-9-3(6)8-4(7)10-5/h1-2H3

InChIKey

VPBDQQVQJHWTFG-UHFFFAOYSA-N

Compound name

4,6-dichloro-N-methoxy-N-methyl-1,3,5-triazin-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 20
Patents: 207.99187 Da
Monoisotopic Mass: 2.4
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]+	208.99915	136.8
[M+Na]+	230.98109	151.2
[M+NH4]+	226.02569	144.5
[M+K]+	246.95503	145.1
[M-H]-	206.98459	137.6
[M+Na-2H]-	228.96654	144.2
[M]+	207.99132	139.5
[M]-	207.99242	139.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe