CID 54703728

4-hydroxy-2-oxo-n'-pentanoyl-1,2-dihydroquinoline-3-carbohydrazide

Structural Information

Molecular Formula
C15H17N3O4
SMILES
CCCCC(=O)NNC(=O)C1=C(C2=CC=CC=C2NC1=O)O
InChI
InChI=1S/C15H17N3O4/c1-2-3-8-11(19)17-18-15(22)12-13(20)9-6-4-5-7-10(9)16-14(12)21/h4-7H,2-3,8H2,1H3,(H,17,19)(H,18,22)(H2,16,20,21)
InChIKey
LVXHQBXTVVRSTB-UHFFFAOYSA-N
Compound name
4-hydroxy-2-oxo-N'-pentanoyl-1H-quinoline-3-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

303.12192 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.12920 167.8
[M+Na]+ 326.11114 174.2
[M-H]- 302.11464 168.5
[M+NH4]+ 321.15574 180.7
[M+K]+ 342.08508 170.1
[M+H-H2O]+ 286.11918 160.2
[M+HCOO]- 348.12012 187.3
[M+CH3COO]- 362.13577 204.6
[M+Na-2H]- 324.09659 171.8
[M]+ 303.12137 167.3
[M]- 303.12247 167.3
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.