CID 9578560

Brn 3085537

Structural Information

Molecular Formula
C16H14Cl2N2O2
SMILES
COC1=C(C=C(C=C1Cl)C(=O)N/N=C/CC2=CC=CC=C2)Cl
InChI
InChI=1S/C16H14Cl2N2O2/c1-22-15-13(17)9-12(10-14(15)18)16(21)20-19-8-7-11-5-3-2-4-6-11/h2-6,8-10H,7H2,1H3,(H,20,21)/b19-8+
InChIKey
AKDFMHPBPGQRKE-UFWORHAWSA-N
Compound name
3,5-dichloro-4-methoxy-N-[(E)-2-phenylethylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

336.04324 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 337.05052 174.9
[M+Na]+ 359.03246 189.7
[M+NH4]+ 354.07706 183.0
[M+K]+ 375.00640 180.5
[M-H]- 335.03596 180.1
[M+Na-2H]- 357.01791 183.7
[M]+ 336.04269 179.1
[M]- 336.04379 179.1
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.