CID 11513987

93103-23-2

Structural Information

Molecular Formula
C10H9FN2S
SMILES
C1=CC(=CC=C1CC2=CNC(=S)N2)F
InChI
InChI=1S/C10H9FN2S/c11-8-3-1-7(2-4-8)5-9-6-12-10(14)13-9/h1-4,6H,5H2,(H2,12,13,14)
InChIKey
GWLZMGMUHBXVIM-UHFFFAOYSA-N
Compound name
4-[(4-fluorophenyl)methyl]-1,3-dihydroimidazole-2-thione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

208.04704 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.05432 140.5
[M+Na]+ 231.03626 151.0
[M-H]- 207.03976 141.5
[M+NH4]+ 226.08086 158.2
[M+K]+ 247.01020 144.2
[M+H-H2O]+ 191.04430 133.1
[M+HCOO]- 253.04524 155.6
[M+CH3COO]- 267.06089 152.7
[M+Na-2H]- 229.02171 141.8
[M]+ 208.04649 137.8
[M]- 208.04759 137.8
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