CID 374788

Nsc653033

Structural Information

Molecular Formula
C16H12Cl2N2O3
SMILES
C1=CC=C(C(=C1)C2C(C(=O)N2NC(=O)C3=CC=CC=C3O)Cl)Cl
InChI
InChI=1S/C16H12Cl2N2O3/c17-11-7-3-1-5-9(11)14-13(18)16(23)20(14)19-15(22)10-6-2-4-8-12(10)21/h1-8,13-14,21H,(H,19,22)
InChIKey
ZOODFJBHTYHNCK-UHFFFAOYSA-N
Compound name
N-[3-chloro-2-(2-chlorophenyl)-4-oxoazetidin-1-yl]-2-hydroxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

350.0225 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.02978 169.7
[M+Na]+ 373.01172 178.3
[M-H]- 349.01522 176.0
[M+NH4]+ 368.05632 175.9
[M+K]+ 388.98566 174.7
[M+H-H2O]+ 333.01976 157.1
[M+HCOO]- 395.02070 180.4
[M+CH3COO]- 409.03635 212.6
[M+Na-2H]- 370.99717 170.7
[M]+ 350.02195 180.7
[M]- 350.02305 180.7
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.