CID 3067844

2h-pyrido(3,2-e)(1,3)thiazine-5-carboxylic acid, 3,4-dihydro-2-(methylimino)-7-methyl-4-oxo-, methyl ester

Structural Information

Molecular Formula
C11H11N3O3S
SMILES
CC1=CC(=C2C(=N1)SC(=NC2=O)NC)C(=O)OC
InChI
InChI=1S/C11H11N3O3S/c1-5-4-6(10(16)17-3)7-8(15)14-11(12-2)18-9(7)13-5/h4H,1-3H3,(H,12,14,15)
InChIKey
NZCOLHDCVBFKBX-UHFFFAOYSA-N
Compound name
methyl 7-methyl-2-(methylamino)-4-oxopyrido[3,2-e][1,3]thiazine-5-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

265.05212 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.059396 154.9
[M+Na]+ 288.041338 165.7
[M-H]- 264.044844 157.8
[M+NH4]+ 283.085943 170.7
[M+K]+ 304.015278 162.1
[M+H-H2O]+ 248.049380 147.6
[M+HCOO]- 310.050321 171.7
[M+CH3COO]- 324.065971 198.4
[M+Na-2H]- 286.026786 159.2
[M]+ 265.05157142 160.6
[M]- 265.05266858 160.6
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.