CID 137851

2-{[(2-chlorophenyl)imino]methyl}phenol

Structural Information

Molecular Formula
C13H10ClNO
SMILES
C1=CC=C(C(=C1)C=NC2=CC=CC=C2Cl)O
InChI
InChI=1S/C13H10ClNO/c14-11-6-2-3-7-12(11)15-9-10-5-1-4-8-13(10)16/h1-9,16H
InChIKey
RJZYMXSMSDKXBO-UHFFFAOYSA-N
Compound name
2-[(2-chlorophenyl)iminomethyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

27
Patents

231.04509 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.05237 148.3
[M+Na]+ 254.03431 157.6
[M-H]- 230.03781 155.3
[M+NH4]+ 249.07891 167.0
[M+K]+ 270.00825 151.9
[M+H-H2O]+ 214.04235 141.9
[M+HCOO]- 276.04329 169.9
[M+CH3COO]- 290.05894 190.4
[M+Na-2H]- 252.01976 155.3
[M]+ 231.04454 150.0
[M]- 231.04564 150.0
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

patents stripe