CID 6482688

4-[6-(ethylamino)pyrazin-2-yl]benzamide

Structural Information

Molecular Formula
C13H14N4O
SMILES
CCNC1=NC(=CN=C1)C2=CC=C(C=C2)C(=O)N
InChI
InChI=1S/C13H14N4O/c1-2-16-12-8-15-7-11(17-12)9-3-5-10(6-4-9)13(14)18/h3-8H,2H2,1H3,(H2,14,18)(H,16,17)
InChIKey
CGXLJDXCJZFCMS-UHFFFAOYSA-N
Compound name
4-[6-(ethylamino)pyrazin-2-yl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

3
Patents

242.11676 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.12404 155.0
[M+Na]+ 265.10598 162.2
[M-H]- 241.10948 158.9
[M+NH4]+ 260.15058 168.8
[M+K]+ 281.07992 158.1
[M+H-H2O]+ 225.11402 145.7
[M+HCOO]- 287.11496 178.0
[M+CH3COO]- 301.13061 198.1
[M+Na-2H]- 263.09143 161.1
[M]+ 242.11621 153.3
[M]- 242.11731 153.3
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