CID 3039690

2-pyrazinecarboxamide, n,n-diethyl-5-methyl-, 4-oxide

Structural Information

Molecular Formula
C10H15N3O2
SMILES
CCN(CC)C(=O)C1=NC=C([N+](=C1)[O-])C
InChI
InChI=1S/C10H15N3O2/c1-4-12(5-2)10(14)9-7-13(15)8(3)6-11-9/h6-7H,4-5H2,1-3H3
InChIKey
BHYXMJXHNJLFOG-UHFFFAOYSA-N
Compound name
N,N-diethyl-5-methyl-4-oxidopyrazin-4-ium-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

209.11642 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.12370 146.0
[M+Na]+ 232.10564 153.7
[M-H]- 208.10914 147.4
[M+NH4]+ 227.15024 162.0
[M+K]+ 248.07958 147.9
[M+H-H2O]+ 192.11368 143.3
[M+HCOO]- 254.11462 168.0
[M+CH3COO]- 268.13027 183.4
[M+Na-2H]- 230.09109 152.5
[M]+ 209.11587 146.2
[M]- 209.11697 146.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe