CID 9575559

[(z)-[amino-(2,4-dichlorophenyl)methylene]amino] 2-phenylbenzoate

Structural Information

Molecular Formula
C20H14Cl2N2O2
SMILES
C1=CC=C(C=C1)C2=CC=CC=C2C(=O)O/N=C(/C3=C(C=C(C=C3)Cl)Cl)\N
InChI
InChI=1S/C20H14Cl2N2O2/c21-14-10-11-17(18(22)12-14)19(23)24-26-20(25)16-9-5-4-8-15(16)13-6-2-1-3-7-13/h1-12H,(H2,23,24)
InChIKey
UPFXFGIJVWCGQD-UHFFFAOYSA-N
Compound name
[(Z)-[amino-(2,4-dichlorophenyl)methylidene]amino] 2-phenylbenzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

384.04324 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 385.05052 188.6
[M+Na]+ 407.03246 196.5
[M-H]- 383.03596 198.3
[M+NH4]+ 402.07706 200.9
[M+K]+ 423.00640 189.5
[M+H-H2O]+ 367.04050 180.2
[M+HCOO]- 429.04144 204.3
[M+CH3COO]- 443.05709 221.7
[M+Na-2H]- 405.01791 190.2
[M]+ 384.04269 192.0
[M]- 384.04379 192.0
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.