CID 194190

64411-76-3

Structural Information

Molecular Formula
C11H8N2OS
SMILES
CC1=CC(=O)N2C3=CC=CC=C3N=C2S1
InChI
InChI=1S/C11H8N2OS/c1-7-6-10(14)13-9-5-3-2-4-8(9)12-11(13)15-7/h2-6H,1H3
InChIKey
XMOVWCGYIZUIIG-UHFFFAOYSA-N
Compound name
2-methyl-[1,3]thiazino[3,2-a]benzimidazol-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

0
Patents

216.03574 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.04302 141.9
[M+Na]+ 239.02496 156.2
[M-H]- 215.02846 146.6
[M+NH4]+ 234.06956 163.4
[M+K]+ 254.99890 151.2
[M+H-H2O]+ 199.03300 136.0
[M+HCOO]- 261.03394 160.8
[M+CH3COO]- 275.04959 156.7
[M+Na-2H]- 237.01041 148.4
[M]+ 216.03519 148.0
[M]- 216.03629 148.0
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

No patent data available for this compound.