CID 121229227

2-chloro-5-iodo-thiazolo[5,4-b]pyridine

Structural Information

Molecular Formula
C6H2ClIN2S
SMILES
C1=CC(=NC2=C1N=C(S2)Cl)I
InChI
InChI=1S/C6H2ClIN2S/c7-6-9-3-1-2-4(8)10-5(3)11-6/h1-2H
InChIKey
DQZBBGQUGHGRRH-UHFFFAOYSA-N
Compound name
2-chloro-5-iodo-[1,3]thiazolo[5,4-b]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

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References

0
Patents

295.8672 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.87448 138.6
[M+Na]+ 318.85642 146.5
[M+NH4]+ 313.90102 144.5
[M+K]+ 334.83036 142.0
[M-H]- 294.85992 134.9
[M+Na-2H]- 316.84187 133.6
[M]+ 295.86665 138.4
[M]- 295.86775 138.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.