CID 10080385

5-fluoro-1,3-thiazol-2-amine

Structural Information

Molecular Formula
C3H3FN2S
SMILES
C1=C(SC(=N1)N)F
InChI
InChI=1S/C3H3FN2S/c4-2-1-6-3(5)7-2/h1H,(H2,5,6)
InChIKey
HUUPNPWVDMNTAH-UHFFFAOYSA-N
Compound name
5-fluoro-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

330
Patents

118.0001 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 119.00738 115.3
[M+Na]+ 140.98932 125.8
[M-H]- 116.99282 116.9
[M+NH4]+ 136.03392 138.6
[M+K]+ 156.96326 123.8
[M+H-H2O]+ 100.99736 109.0
[M+HCOO]- 162.99830 135.3
[M+CH3COO]- 177.01395 167.7
[M+Na-2H]- 138.97477 118.8
[M]+ 117.99955 114.1
[M]- 118.00065 114.1
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

patents stripe