CID 9635224

305850-60-6

Structural Information

Molecular Formula
C15H12ClN3O2
SMILES
C1=CC=C(C=C1)NC(=O)C(=O)N/N=C/C2=CC=C(C=C2)Cl
InChI
InChI=1S/C15H12ClN3O2/c16-12-8-6-11(7-9-12)10-17-19-15(21)14(20)18-13-4-2-1-3-5-13/h1-10H,(H,18,20)(H,19,21)/b17-10+
InChIKey
NALKXNVUTKUUPW-LICLKQGHSA-N
Compound name
N'-[(E)-(4-chlorophenyl)methylideneamino]-N-phenyloxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

301.0618 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 302.06908 168.0
[M+Na]+ 324.05102 174.2
[M-H]- 300.05452 175.9
[M+NH4]+ 319.09562 183.3
[M+K]+ 340.02496 169.5
[M+H-H2O]+ 284.05906 160.1
[M+HCOO]- 346.06000 191.2
[M+CH3COO]- 360.07565 208.1
[M+Na-2H]- 322.03647 173.5
[M]+ 301.06125 169.2
[M]- 301.06235 169.2
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.