CID 3559329

112628-75-8

Structural Information

Molecular Formula
C14H12ClNO2
SMILES
COC1=CC=CC(=C1O)C=NC2=CC(=CC=C2)Cl
InChI
InChI=1S/C14H12ClNO2/c1-18-13-7-2-4-10(14(13)17)9-16-12-6-3-5-11(15)8-12/h2-9,17H,1H3
InChIKey
HJIVIDAUWQSCBR-UHFFFAOYSA-N
Compound name
2-[(3-chlorophenyl)iminomethyl]-6-methoxyphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

261.05566 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.06294 155.9
[M+Na]+ 284.04488 165.6
[M-H]- 260.04838 163.1
[M+NH4]+ 279.08948 173.6
[M+K]+ 300.01882 160.3
[M+H-H2O]+ 244.05292 149.3
[M+HCOO]- 306.05386 177.4
[M+CH3COO]- 320.06951 196.7
[M+Na-2H]- 282.03033 161.7
[M]+ 261.05511 159.8
[M]- 261.05621 159.8
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.