CID 28063231

1269151-25-8

Structural Information

Molecular Formula

C₈H₁₃N₃

SMILES

CC1=CC(=NC(=N1)CCN)C

InChI

InChI=1S/C8H13N3/c1-6-5-7(2)11-8(10-6)3-4-9/h5H,3-4,9H2,1-2H3

InChIKey

JLCZNKONOKKWEP-UHFFFAOYSA-N

Compound name

2-(4,6-dimethylpyrimidin-2-yl)ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 151.11095 Da
Monoisotopic Mass: 0.4
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]+	152.118226	133.0
[M+Na]+	174.100168	142.0
[M-H]-	150.103674	133.9
[M+NH4]+	169.144773	151.7
[M+K]+	190.074108	139.6
[M+H-H2O]+	134.108210	125.9
[M+HCOO]-	196.109151	155.7
[M+CH3COO]-	210.124801	180.1
[M+Na-2H]-	172.085616	139.7
[M]+	151.11040142	132.6
[M]-	151.11149858	132.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe