CID 9579383

Benzylidene-[4-(4-methoxy-phenyl)-thiazol-2-yl]-amine

Structural Information

Molecular Formula
C17H14N2OS
SMILES
COC1=CC=C(C=C1)C2=CSC(=N2)/N=C/C3=CC=CC=C3
InChI
InChI=1S/C17H14N2OS/c1-20-15-9-7-14(8-10-15)16-12-21-17(19-16)18-11-13-5-3-2-4-6-13/h2-12H,1H3/b18-11+
InChIKey
UXTJOFUTIYYVII-WOJGMQOQSA-N
Compound name
(E)-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-1-phenylmethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

294.08267 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.08995 167.0
[M+Na]+ 317.07189 176.2
[M-H]- 293.07539 177.5
[M+NH4]+ 312.11649 183.8
[M+K]+ 333.04583 170.8
[M+H-H2O]+ 277.07993 158.2
[M+HCOO]- 339.08087 189.4
[M+CH3COO]- 353.09652 179.8
[M+Na-2H]- 315.05734 169.7
[M]+ 294.08212 170.8
[M]- 294.08322 170.8
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.