CID 54685666

4-hydroxy-2-oxo-n'-propionyl-1-propyl-1,2-dihydro-3-quinolinecarbohydrazide

Structural Information

Molecular Formula
C16H19N3O4
SMILES
CCCN1C2=CC=CC=C2C(=C(C1=O)C(=O)NNC(=O)CC)O
InChI
InChI=1S/C16H19N3O4/c1-3-9-19-11-8-6-5-7-10(11)14(21)13(16(19)23)15(22)18-17-12(20)4-2/h5-8,21H,3-4,9H2,1-2H3,(H,17,20)(H,18,22)
InChIKey
QUNDKECZTKKGKZ-UHFFFAOYSA-N
Compound name
4-hydroxy-2-oxo-N'-propanoyl-1-propylquinoline-3-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

317.13754 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 318.144816 172.6
[M+Na]+ 340.126758 179.8
[M-H]- 316.130264 174.8
[M+NH4]+ 335.171363 185.9
[M+K]+ 356.100698 176.4
[M+H-H2O]+ 300.134800 164.7
[M+HCOO]- 362.135741 193.2
[M+CH3COO]- 376.151391 211.1
[M+Na-2H]- 338.112206 175.7
[M]+ 317.13699142 174.6
[M]- 317.13808858 174.6
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.