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]+ 210.123696 146.0
[M+Na]+ 232.105638 153.7
[M-H]- 208.109144 147.4
[M+NH4]+ 227.150243 162.0
[M+K]+ 248.079578 147.9
[M+H-H2O]+ 192.113680 143.3
[M+HCOO]- 254.114621 168.0
[M+CH3COO]- 268.130271 183.4
[M+Na-2H]- 230.091086 152.5
[M]+ 209.11587142 146.2
[M]- 209.11696858 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