CID 641190

92175-88-7

Structural Information

Molecular Formula

C₁₅H₁₄ClNO₃

SMILES

COC1=CC(=C(C=C1N=CC2=CC=CC=C2O)Cl)OC

InChI

InChI=1S/C15H14ClNO3/c1-19-14-8-15(20-2)12(7-11(14)16)17-9-10-5-3-4-6-13(10)18/h3-9,18H,1-2H3

InChIKey

VTSXAEWTTOXZHR-UHFFFAOYSA-N

Compound name

2-[(5-chloro-2,4-dimethoxyphenyl)iminomethyl]phenol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 291.06622 Da
Monoisotopic Mass: 3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	292.073496	163.2
[M+Na]+	314.055438	173.2
[M-H]-	290.058944	170.7
[M+NH4]+	309.100043	179.9
[M+K]+	330.029378	168.5
[M+H-H2O]+	274.063480	156.4
[M+HCOO]-	336.064421	184.6
[M+CH3COO]-	350.080071	203.0
[M+Na-2H]-	312.040886	167.8
[M]+	291.06567142	169.3
[M]-	291.06676858	169.3

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.