CID 3153353

2-amino-4-oxo-5,6-dihydro-1,3-thiazine-6-carboxylic acid

Structural Information

Molecular Formula
C5H6N2O3S
SMILES
C1C(SC(=NC1=O)N)C(=O)O
InChI
InChI=1S/C5H6N2O3S/c6-5-7-3(8)1-2(11-5)4(9)10/h2H,1H2,(H,9,10)(H2,6,7,8)
InChIKey
VVWUMKXFIHHFOT-UHFFFAOYSA-N
Compound name
2-amino-4-oxo-5,6-dihydro-1,3-thiazine-6-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

174.00992 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.01720 133.3
[M+Na]+ 196.99914 142.2
[M+NH4]+ 192.04374 140.0
[M+K]+ 212.97308 137.2
[M-H]- 173.00264 133.1
[M+Na-2H]- 194.98459 136.1
[M]+ 174.00937 134.5
[M]- 174.01047 134.5
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.