CID 79884535

2-(3-chlorophenyl)-1,3-thiazol-4-amine dihydrochloride

Structural Information

Molecular Formula
C9H7ClN2S
SMILES
C1=CC(=CC(=C1)Cl)C2=NC(=CS2)N
InChI
InChI=1S/C9H7ClN2S/c10-7-3-1-2-6(4-7)9-12-8(11)5-13-9/h1-5H,11H2
InChIKey
UNEXJCJBOQYSJT-UHFFFAOYSA-N
Compound name
2-(3-chlorophenyl)-1,3-thiazol-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

210.00185 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.00913 141.3
[M+Na]+ 232.99107 155.5
[M+NH4]+ 228.03567 151.5
[M+K]+ 248.96501 147.5
[M-H]- 208.99457 146.2
[M+Na-2H]- 230.97652 149.8
[M]+ 210.00130 145.5
[M]- 210.00240 145.5
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.