CID 3058057

74417-17-7

Structural Information

Molecular Formula

C₇H₁₁N₃O

SMILES

CCOC1=NC(=C(N=N1)C)C

InChI

InChI=1S/C7H11N3O/c1-4-11-7-8-5(2)6(3)9-10-7/h4H2,1-3H3

InChIKey

FAHSHESULNYEEV-UHFFFAOYSA-N

Compound name

3-ethoxy-5,6-dimethyl-1,2,4-triazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 153.09021 Da
Monoisotopic Mass: 0.7
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]+	154.09749	131.8
[M+Na]+	176.07943	145.7
[M+NH4]+	171.12403	139.2
[M+K]+	192.05337	139.7
[M-H]-	152.08293	132.2
[M+Na-2H]-	174.06488	138.7
[M]+	153.08966	133.8
[M]-	153.09076	133.8

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.