CID 6510189

Brn 4264838

Structural Information

Molecular Formula
C17H15ClN2O2
SMILES
C/C(=N/NC(=O)C1C(O1)C2=CC=CC=C2)/C3=CC=CC=C3Cl
InChI
InChI=1S/C17H15ClN2O2/c1-11(13-9-5-6-10-14(13)18)19-20-17(21)16-15(22-16)12-7-3-2-4-8-12/h2-10,15-16H,1H3,(H,20,21)/b19-11-
InChIKey
QDAMCKJYEISSPE-ODLFYWEKSA-N
Compound name
N-[(Z)-1-(2-chlorophenyl)ethylideneamino]-3-phenyloxirane-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

314.0822 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.08948 171.9
[M+Na]+ 337.07142 187.2
[M+NH4]+ 332.11602 180.7
[M+K]+ 353.04536 181.0
[M-H]- 313.07492 186.3
[M+Na-2H]- 335.05687 183.3
[M]+ 314.08165 179.6
[M]- 314.08275 179.6
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.