CID 5402190

Pyrazine-2-carboxylic acid (4-methyl-benzylidene)-hydrazide

Structural Information

Molecular Formula
C13H12N4O
SMILES
CC1=CC=C(C=C1)/C=N\NC(=O)C2=NC=CN=C2
InChI
InChI=1S/C13H12N4O/c1-10-2-4-11(5-3-10)8-16-17-13(18)12-9-14-6-7-15-12/h2-9H,1H3,(H,17,18)/b16-8-
InChIKey
JWOZQYYTUNWYCE-PXNMLYILSA-N
Compound name
N-[(Z)-(4-methylphenyl)methylideneamino]pyrazine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.1011 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.10838 153.5
[M+Na]+ 263.09032 160.6
[M-H]- 239.09382 158.9
[M+NH4]+ 258.13492 168.0
[M+K]+ 279.06426 157.0
[M+H-H2O]+ 223.09836 143.6
[M+HCOO]- 285.09930 178.7
[M+CH3COO]- 299.11495 197.8
[M+Na-2H]- 261.07577 161.8
[M]+ 240.10055 153.3
[M]- 240.10165 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

No literature data available for this compound.

Patent stripe

No patent data available for this compound.