CID 54675958

302904-34-3

Structural Information

Molecular Formula
C19H15Cl2N3O4
SMILES
CCN1C2=CC=CC=C2C(=C(C1=O)C(=O)NNC(=O)C3=C(C=C(C=C3)Cl)Cl)O
InChI
InChI=1S/C19H15Cl2N3O4/c1-2-24-14-6-4-3-5-12(14)16(25)15(19(24)28)18(27)23-22-17(26)11-8-7-10(20)9-13(11)21/h3-9,25H,2H2,1H3,(H,22,26)(H,23,27)
InChIKey
OZMWLLNCBKSHII-UHFFFAOYSA-N
Compound name
N'-(2,4-dichlorobenzoyl)-1-ethyl-4-hydroxy-2-oxoquinoline-3-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

419.04398 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 420.05126 191.8
[M+Na]+ 442.03320 201.8
[M-H]- 418.03670 197.1
[M+NH4]+ 437.07780 202.5
[M+K]+ 458.00714 195.2
[M+H-H2O]+ 402.04124 184.8
[M+HCOO]- 464.04218 203.3
[M+CH3COO]- 478.05783 226.3
[M+Na-2H]- 440.01865 193.6
[M]+ 419.04343 197.3
[M]- 419.04453 197.3
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.