CID 216678

37591-10-9

Structural Information

Molecular Formula
C8H9N3OS
SMILES
COC1=NC2=C(C=C1)N=C(CS2)N
InChI
InChI=1S/C8H9N3OS/c1-12-7-3-2-5-8(11-7)13-4-6(9)10-5/h2-3H,4H2,1H3,(H2,9,10)
InChIKey
UVHCJTYFEBAOIK-UHFFFAOYSA-N
Compound name
6-methoxy-3H-pyrido[2,3-b][1,4]thiazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

195.04663 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.05391 136.9
[M+Na]+ 218.03585 146.6
[M-H]- 194.03935 138.7
[M+NH4]+ 213.08045 155.1
[M+K]+ 234.00979 143.1
[M+H-H2O]+ 178.04389 130.0
[M+HCOO]- 240.04483 153.2
[M+CH3COO]- 254.06048 149.7
[M+Na-2H]- 216.02130 143.1
[M]+ 195.04608 137.7
[M]- 195.04718 137.7
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.