CID 2049844

78364-55-3

Structural Information

Molecular Formula
C7H6FN3S
SMILES
C1=CC2=C(C=C1F)SC(=N2)NN
InChI
InChI=1S/C7H6FN3S/c8-4-1-2-5-6(3-4)12-7(10-5)11-9/h1-3H,9H2,(H,10,11)
InChIKey
QODXZESJVXQCSC-UHFFFAOYSA-N
Compound name
(6-fluoro-1,3-benzothiazol-2-yl)hydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

37
Patents

183.02664 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.03392 129.1
[M+Na]+ 206.01586 140.7
[M-H]- 182.01936 132.0
[M+NH4]+ 201.06046 151.0
[M+K]+ 221.98980 136.4
[M+H-H2O]+ 166.02390 122.5
[M+HCOO]- 228.02484 150.5
[M+CH3COO]- 242.04049 143.6
[M+Na-2H]- 204.00131 135.2
[M]+ 183.02609 129.8
[M]- 183.02719 129.8
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