CID 135764811

5-chlorosalicylaldehyde o-(m-chlorobenzyl)oxime

Structural Information

Molecular Formula
C14H11Cl2NO2
SMILES
C1=CC(=CC(=C1)Cl)CO/N=C/C2=C(C=CC(=C2)Cl)O
InChI
InChI=1S/C14H11Cl2NO2/c15-12-3-1-2-10(6-12)9-19-17-8-11-7-13(16)4-5-14(11)18/h1-8,18H,9H2/b17-8+
InChIKey
BIDGMQYVKKRUDT-CAOOACKPSA-N
Compound name
4-chloro-2-[(E)-(3-chlorophenyl)methoxyiminomethyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.0167 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.02398 162.2
[M+Na]+ 318.00592 172.2
[M-H]- 294.00942 168.5
[M+NH4]+ 313.05052 178.9
[M+K]+ 333.97986 165.7
[M+H-H2O]+ 278.01396 156.2
[M+HCOO]- 340.01490 178.5
[M+CH3COO]- 354.03055 201.0
[M+Na-2H]- 315.99137 167.1
[M]+ 295.01615 167.3
[M]- 295.01725 167.3
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.