CID 2608755

5-phenyl-7-(trifluoromethyl)-[1,3]thiazolo[4,5-b]pyridin-2-amine

Structural Information

Molecular Formula
C13H8F3N3S
SMILES
C1=CC=C(C=C1)C2=NC3=C(C(=C2)C(F)(F)F)SC(=N3)N
InChI
InChI=1S/C13H8F3N3S/c14-13(15,16)8-6-9(7-4-2-1-3-5-7)18-11-10(8)20-12(17)19-11/h1-6H,(H2,17,18,19)
InChIKey
QGJXVDRECTZYDN-UHFFFAOYSA-N
Compound name
5-phenyl-7-(trifluoromethyl)-[1,3]thiazolo[4,5-b]pyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

0
Patents

295.0391 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.04638 159.6
[M+Na]+ 318.02832 172.4
[M-H]- 294.03182 161.9
[M+NH4]+ 313.07292 175.9
[M+K]+ 334.00226 165.4
[M+H-H2O]+ 278.03636 149.9
[M+HCOO]- 340.03730 174.6
[M+CH3COO]- 354.05295 171.5
[M+Na-2H]- 316.01377 163.2
[M]+ 295.03855 158.9
[M]- 295.03965 158.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.