CID 7420745

N'-[(1e)-1-(3-bromophenyl)ethylidene]pyrazine-2-carbohydrazide

Structural Information

Molecular Formula
C13H11BrN4O
SMILES
C/C(=N\NC(=O)C1=NC=CN=C1)/C2=CC(=CC=C2)Br
InChI
InChI=1S/C13H11BrN4O/c1-9(10-3-2-4-11(14)7-10)17-18-13(19)12-8-15-5-6-16-12/h2-8H,1H3,(H,18,19)/b17-9+
InChIKey
SRYUPEIJTLBQDN-RQZCQDPDSA-N
Compound name
N-[(E)-1-(3-bromophenyl)ethylideneamino]pyrazine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

318.01163 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.01891 160.1
[M+Na]+ 341.00085 169.4
[M-H]- 317.00435 167.7
[M+NH4]+ 336.04545 175.2
[M+K]+ 356.97479 157.7
[M+H-H2O]+ 301.00889 156.5
[M+HCOO]- 363.00983 181.7
[M+CH3COO]- 377.02548 207.4
[M+Na-2H]- 338.98630 168.2
[M]+ 318.01108 177.9
[M]- 318.01218 177.9
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.