CID 92135071

(3,5-dichloropyrazin-2-yl)methanamine hydrochloride

Structural Information

Molecular Formula

C₅H₅Cl₂N₃

SMILES

C1=C(N=C(C(=N1)CN)Cl)Cl

InChI

InChI=1S/C5H5Cl2N3/c6-4-2-9-3(1-8)5(7)10-4/h2H,1,8H2

InChIKey

YBOFANNRTUZILT-UHFFFAOYSA-N

Compound name

(3,5-dichloropyrazin-2-yl)methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 10
Patents: 176.98605 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]+	177.99333	130.1
[M+Na]+	199.97527	144.8
[M+NH4]+	195.01987	138.9
[M+K]+	215.94921	137.7
[M-H]-	175.97877	131.9
[M+Na-2H]-	197.96072	137.8
[M]+	176.98550	133.2
[M]-	176.98660	133.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe