CID 3040993

Brn 0986307

Structural Information

Molecular Formula
C9H11N3OS
SMILES
CCN1C(=O)C(SC2=NC=CN=C21)C
InChI
InChI=1S/C9H11N3OS/c1-3-12-7-8(11-5-4-10-7)14-6(2)9(12)13/h4-6H,3H2,1-2H3
InChIKey
NCEJRBFCXYNDRQ-UHFFFAOYSA-N
Compound name
4-ethyl-2-methylpyrazino[2,3-b][1,4]thiazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

209.06229 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.06957 145.1
[M+Na]+ 232.05151 158.7
[M+NH4]+ 227.09611 153.5
[M+K]+ 248.02545 150.0
[M-H]- 208.05501 146.3
[M+Na-2H]- 230.03696 150.0
[M]+ 209.06174 147.8
[M]- 209.06284 147.8
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.