CID 3064611

7h-thiazolo(3,2-a)pyrimidin-7-one, 5-(n-methylanilino)-

Structural Information

Molecular Formula
C13H11N3OS
SMILES
CN(C1=CC=CC=C1)C2=CC(=O)N=C3N2C=CS3
InChI
InChI=1S/C13H11N3OS/c1-15(10-5-3-2-4-6-10)12-9-11(17)14-13-16(12)7-8-18-13/h2-9H,1H3
InChIKey
HUDYCTVZTXRIOW-UHFFFAOYSA-N
Compound name
5-(N-methylanilino)-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

257.0623 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.06958 153.1
[M+Na]+ 280.05152 168.4
[M+NH4]+ 275.09612 162.5
[M+K]+ 296.02546 160.6
[M-H]- 256.05502 158.1
[M+Na-2H]- 278.03697 162.8
[M]+ 257.06175 157.3
[M]- 257.06285 157.3
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.

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No patent data available for this compound.