CID 14983719

2,4-diamino-5-methoxymethylpyrimidine

Structural Information

Molecular Formula

C₆H₁₀N₄O

SMILES

COCC1=CN=C(N=C1N)N

InChI

InChI=1S/C6H10N4O/c1-11-3-4-2-9-6(8)10-5(4)7/h2H,3H2,1H3,(H4,7,8,9,10)

InChIKey

MICPTYSZVFPCLL-UHFFFAOYSA-N

Compound name

5-(methoxymethyl)pyrimidine-2,4-diamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 11
Patents: 154.08546 Da
Monoisotopic Mass: -0.8
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]+	155.09274	130.1
[M+Na]+	177.07468	141.2
[M+NH4]+	172.11928	137.1
[M+K]+	193.04862	136.6
[M-H]-	153.07818	131.5
[M+Na-2H]-	175.06013	136.2
[M]+	154.08491	131.7
[M]-	154.08601	131.7

Literature stripe

literature stripe

Patent stripe

patents stripe