CID 511722

N-(1,2-benzothiazol-3-yl)-1-(4-methoxyphenyl)methanimine

Structural Information

Molecular Formula
C15H12N2OS
SMILES
COC1=CC=C(C=C1)C=NC2=NSC3=CC=CC=C32
InChI
InChI=1S/C15H12N2OS/c1-18-12-8-6-11(7-9-12)10-16-15-13-4-2-3-5-14(13)19-17-15/h2-10H,1H3
InChIKey
GFCULCXZSLYMRD-UHFFFAOYSA-N
Compound name
N-(1,2-benzothiazol-3-yl)-1-(4-methoxyphenyl)methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

268.06705 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.074326 158.1
[M+Na]+ 291.056268 169.3
[M-H]- 267.059774 166.9
[M+NH4]+ 286.100873 177.5
[M+K]+ 307.030208 164.3
[M+H-H2O]+ 251.064310 150.5
[M+HCOO]- 313.065251 181.1
[M+CH3COO]- 327.080901 172.0
[M+Na-2H]- 289.041716 163.7
[M]+ 268.06650142 164.2
[M]- 268.06759858 164.2
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

No patent data available for this compound.