CID 216615

37489-37-5

Structural Information

Molecular Formula
C7H6ClN3S
SMILES
C1C(=NC2=C(S1)N=C(C=C2)Cl)N
InChI
InChI=1S/C7H6ClN3S/c8-5-2-1-4-7(11-5)12-3-6(9)10-4/h1-2H,3H2,(H2,9,10)
InChIKey
XEPICHAJWHTWLU-UHFFFAOYSA-N
Compound name
6-chloro-3H-pyrido[2,3-b][1,4]thiazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

198.9971 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.00438 134.6
[M+Na]+ 221.98632 145.4
[M-H]- 197.98982 136.4
[M+NH4]+ 217.03092 153.6
[M+K]+ 237.96026 140.2
[M+H-H2O]+ 181.99436 128.8
[M+HCOO]- 243.99530 146.3
[M+CH3COO]- 258.01095 147.5
[M+Na-2H]- 219.97177 140.7
[M]+ 198.99655 135.4
[M]- 198.99765 135.4
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.