CID 14892245

20358-08-1

Structural Information

Molecular Formula
C7H5FN2S
SMILES
C1=CC2=C(C(=C1)F)SC(=N2)N
InChI
InChI=1S/C7H5FN2S/c8-4-2-1-3-5-6(4)11-7(9)10-5/h1-3H,(H2,9,10)
InChIKey
YWMZTMFZBAXQSS-UHFFFAOYSA-N
Compound name
7-fluoro-1,3-benzothiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

59
Patents

168.01575 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.02303 127.7
[M+Na]+ 191.00497 140.3
[M+NH4]+ 186.04957 137.3
[M+K]+ 206.97891 133.6
[M-H]- 167.00847 129.6
[M+Na-2H]- 188.99042 134.2
[M]+ 168.01520 130.4
[M]- 168.01630 130.4
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

patents stripe