CID 12299630

2228462-31-3

Structural Information

Molecular Formula
C8H10N4
SMILES
C1=CN=C2C(=N1)C(=CN2)CCN
InChI
InChI=1S/C8H10N4/c9-2-1-6-5-12-8-7(6)10-3-4-11-8/h3-5H,1-2,9H2,(H,11,12)
InChIKey
WNAQINQXEUEJMI-UHFFFAOYSA-N
Compound name
2-(5H-pyrrolo[2,3-b]pyrazin-7-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

162.09055 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.09783 131.6
[M+Na]+ 185.07977 144.2
[M+NH4]+ 180.12437 139.5
[M+K]+ 201.05371 139.9
[M-H]- 161.08327 132.4
[M+Na-2H]- 183.06522 138.2
[M]+ 162.09000 133.4
[M]- 162.09110 133.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe