CID 483776

Chembl321479

Structural Information

Molecular Formula
C17H13N5O
SMILES
C1=CC=C2C(=C1)N=C(C3=CC=CN23)NNC(=O)C4=CC=CC=N4
InChI
InChI=1S/C17H13N5O/c23-17(13-7-3-4-10-18-13)21-20-16-15-9-5-11-22(15)14-8-2-1-6-12(14)19-16/h1-11H,(H,19,20)(H,21,23)
InChIKey
ATBPDWLCYWFKEF-UHFFFAOYSA-N
Compound name
N'-pyrrolo[1,2-a]quinoxalin-4-ylpyridine-2-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

303.112 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.11928 165.2
[M+Na]+ 326.10122 174.1
[M-H]- 302.10472 170.5
[M+NH4]+ 321.14582 178.9
[M+K]+ 342.07516 167.9
[M+H-H2O]+ 286.10926 154.8
[M+HCOO]- 348.11020 187.7
[M+CH3COO]- 362.12585 176.3
[M+Na-2H]- 324.08667 175.0
[M]+ 303.11145 166.1
[M]- 303.11255 166.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.