CID 82594697

1-(pyrazin-2-yl)cyclobutan-1-amine hydrochloride

Structural Information

Molecular Formula

C₈H₁₁N₃

SMILES

C1CC(C1)(C2=NC=CN=C2)N

InChI

InChI=1S/C8H11N3/c9-8(2-1-3-8)7-6-10-4-5-11-7/h4-6H,1-3,9H2

InChIKey

WWYSYRUEYMFGPX-UHFFFAOYSA-N

Compound name

1-pyrazin-2-ylcyclobutan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 149.09529 Da
Monoisotopic Mass: -0.6
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]+	150.102566	131.0
[M+Na]+	172.084508	137.5
[M-H]-	148.088014	134.4
[M+NH4]+	167.129113	144.3
[M+K]+	188.058448	138.4
[M+H-H2O]+	132.092550	118.5
[M+HCOO]-	194.093491	151.9
[M+CH3COO]-	208.109141	179.1
[M+Na-2H]-	170.069956	139.6
[M]+	149.09474142	135.9
[M]-	149.09583858	135.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe