CID 48882

Brn 0923845

Structural Information

Molecular Formula
C15H20N6
SMILES
CCC(C)(C)N=C(NC1=CN=CC=C1)NC2=NC=CN=C2
InChI
InChI=1S/C15H20N6/c1-4-15(2,3)21-14(19-12-6-5-7-16-10-12)20-13-11-17-8-9-18-13/h5-11H,4H2,1-3H3,(H2,18,19,20,21)
InChIKey
DFKGDFMGOABGCI-UHFFFAOYSA-N
Compound name
2-(2-methylbutan-2-yl)-1-pyrazin-2-yl-3-pyridin-3-ylguanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

284.17496 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.18224 167.1
[M+Na]+ 307.16418 178.2
[M+NH4]+ 302.20878 173.2
[M+K]+ 323.13812 172.0
[M-H]- 283.16768 170.7
[M+Na-2H]- 305.14963 176.4
[M]+ 284.17441 169.5
[M]- 284.17551 169.5
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

No patent data available for this compound.