CID 3039036

Brn 2999285

Structural Information

Molecular Formula
C15H12ClNO4
SMILES
C1=CC=C(C(=C1)C(=O)NC(C(=O)C2=CC=C(C=C2)Cl)O)O
InChI
InChI=1S/C15H12ClNO4/c16-10-7-5-9(6-8-10)13(19)15(21)17-14(20)11-3-1-2-4-12(11)18/h1-8,15,18,21H,(H,17,20)
InChIKey
QDPFOUHHWQQQIX-UHFFFAOYSA-N
Compound name
N-[2-(4-chlorophenyl)-1-hydroxy-2-oxoethyl]-2-hydroxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

305.04547 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.05275 164.7
[M+Na]+ 328.03469 171.2
[M-H]- 304.03819 169.0
[M+NH4]+ 323.07929 178.4
[M+K]+ 344.00863 166.5
[M+H-H2O]+ 288.04273 158.5
[M+HCOO]- 350.04367 180.6
[M+CH3COO]- 364.05932 200.0
[M+Na-2H]- 326.02014 166.4
[M]+ 305.04492 165.4
[M]- 305.04602 165.4
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.