CID 26879

Levamisole

Structural Information

Molecular Formula

C₁₁H₁₂N₂S

SMILES

C1CSC2=N[C@H](CN21)C3=CC=CC=C3

InChI

InChI=1S/C11H12N2S/c1-2-4-9(5-3-1)10-8-13-6-7-14-11(13)12-10/h1-5,10H,6-8H2/t10-/m1/s1

InChIKey

HLFSDGLLUJUHTE-SNVBAGLBSA-N

Compound name

(6S)-6-phenyl-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole

Related CIDs

2D Structure

compound 2d structure

8
Annotation Hits: 5579
References: 86385
Patents: 204.07211 Da
Monoisotopic Mass: 1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	205.07939	143.4
[M+Na]+	227.06133	152.8
[M-H]-	203.06483	149.0
[M+NH4]+	222.10593	165.3
[M+K]+	243.03527	149.6
[M+H-H2O]+	187.06937	136.9
[M+HCOO]-	249.07031	160.3
[M+CH3COO]-	263.08596	156.7
[M+Na-2H]-	225.04678	144.6
[M]+	204.07156	143.5
[M]-	204.07266	143.5

Literature stripe

literature stripe

Patent stripe

patents stripe