CID 24846809

Brn 4497898

Structural Information

Molecular Formula
C18H14N2OS
SMILES
CC1=CC(=CC(=C1)/C=C/2\C(=O)N3C4=CC=CC=C4N=C3S2)C
InChI
InChI=1S/C18H14N2OS/c1-11-7-12(2)9-13(8-11)10-16-17(21)20-15-6-4-3-5-14(15)19-18(20)22-16/h3-10H,1-2H3/b16-10+
InChIKey
WOSYCFJRYCOGJY-MHWRWJLKSA-N
Compound name
(2E)-2-[(3,5-dimethylphenyl)methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

306.08267 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.08995 170.0
[M+Na]+ 329.07189 187.5
[M+NH4]+ 324.11649 179.7
[M+K]+ 345.04583 179.6
[M-H]- 305.07539 174.9
[M+Na-2H]- 327.05734 177.8
[M]+ 306.08212 174.7
[M]- 306.08322 174.7
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.