CID 9634200

374090-33-2

Structural Information

Molecular Formula
C17H12Cl2N2O
SMILES
C1=CC=C(C=C1)N/N=C/C2=CC=C(O2)C3=CC(=C(C=C3)Cl)Cl
InChI
InChI=1S/C17H12Cl2N2O/c18-15-8-6-12(10-16(15)19)17-9-7-14(22-17)11-20-21-13-4-2-1-3-5-13/h1-11,21H/b20-11+
InChIKey
MMPPVVTTZHVPFY-RGVLZGJSSA-N
Compound name
N-[(E)-[5-(3,4-dichlorophenyl)furan-2-yl]methylideneamino]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

330.03265 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 331.03993 178.5
[M+Na]+ 353.02187 188.1
[M-H]- 329.02537 189.5
[M+NH4]+ 348.06647 194.1
[M+K]+ 368.99581 181.6
[M+H-H2O]+ 313.02991 170.8
[M+HCOO]- 375.03085 196.9
[M+CH3COO]- 389.04650 190.6
[M+Na-2H]- 351.00732 182.5
[M]+ 330.03210 183.4
[M]- 330.03320 183.4
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

patents stripe