CID 372425

Nsc647538

Structural Information

Molecular Formula
C15H10N2OS
SMILES
CC1=NC2=C(S1)C=C3C(=C2)NC4=CC=CC=C4C3=O
InChI
InChI=1S/C15H10N2OS/c1-8-16-13-7-12-10(6-14(13)19-8)15(18)9-4-2-3-5-11(9)17-12/h2-7H,1H3,(H,17,18)
InChIKey
UYKDXAGVOUDQQR-UHFFFAOYSA-N
Compound name
2-methyl-5H-[1,3]thiazolo[5,4-b]acridin-10-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

266.0514 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.05868 155.5
[M+Na]+ 289.04062 170.6
[M-H]- 265.04412 160.0
[M+NH4]+ 284.08522 175.3
[M+K]+ 305.01456 163.2
[M+H-H2O]+ 249.04866 149.3
[M+HCOO]- 311.04960 172.6
[M+CH3COO]- 325.06525 169.2
[M+Na-2H]- 287.02607 162.8
[M]+ 266.05085 161.7
[M]- 266.05195 161.7
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.