CID 9574918

N-[(e)-(4-acetamidophenyl)methyleneamino]pyrazine-2-carboxamide

Structural Information

Molecular Formula
C14H13N5O2
SMILES
CC(=O)NC1=CC=C(C=C1)/C=N/NC(=O)C2=NC=CN=C2
InChI
InChI=1S/C14H13N5O2/c1-10(20)18-12-4-2-11(3-5-12)8-17-19-14(21)13-9-15-6-7-16-13/h2-9H,1H3,(H,18,20)(H,19,21)/b17-8+
InChIKey
DTRZFNJHYIQZCX-CAOOACKPSA-N
Compound name
N-[(E)-(4-acetamidophenyl)methylideneamino]pyrazine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

283.10693 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.11421 163.6
[M+Na]+ 306.09615 169.3
[M-H]- 282.09965 169.0
[M+NH4]+ 301.14075 175.8
[M+K]+ 322.07009 166.1
[M+H-H2O]+ 266.10419 153.2
[M+HCOO]- 328.10513 189.0
[M+CH3COO]- 342.12078 207.5
[M+Na-2H]- 304.08160 170.8
[M]+ 283.10638 163.1
[M]- 283.10748 163.1
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

No patent data available for this compound.