CID 463806

4-methyl-3-(4-phenylpyrrolo[1,2-a]quinoxalin-2-yl)-1h-pyrrole-2-carbohydrazide

Structural Information

Molecular Formula
C23H19N5O
SMILES
CC1=CNC(=C1C2=CN3C4=CC=CC=C4N=C(C3=C2)C5=CC=CC=C5)C(=O)NN
InChI
InChI=1S/C23H19N5O/c1-14-12-25-22(23(29)27-24)20(14)16-11-19-21(15-7-3-2-4-8-15)26-17-9-5-6-10-18(17)28(19)13-16/h2-13,25H,24H2,1H3,(H,27,29)
InChIKey
QKSSNMMHVZVCOP-UHFFFAOYSA-N
Compound name
4-methyl-3-(4-phenylpyrrolo[1,2-a]quinoxalin-2-yl)-1H-pyrrole-2-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

381.15897 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 382.16625 188.6
[M+Na]+ 404.14819 199.0
[M-H]- 380.15169 197.1
[M+NH4]+ 399.19279 200.6
[M+K]+ 420.12213 190.6
[M+H-H2O]+ 364.15623 178.9
[M+HCOO]- 426.15717 210.4
[M+CH3COO]- 440.17282 198.9
[M+Na-2H]- 402.13364 191.8
[M]+ 381.15842 190.1
[M]- 381.15952 190.1
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.