CID 433485

26847-27-8

Structural Information

Molecular Formula
C15H19ClN2OS
SMILES
CCCCC1C(N2CCN=C2S1)(C3=CC=C(C=C3)Cl)O
InChI
InChI=1S/C15H19ClN2OS/c1-2-3-4-13-15(19,11-5-7-12(16)8-6-11)18-10-9-17-14(18)20-13/h5-8,13,19H,2-4,9-10H2,1H3
InChIKey
OFULIMNERCHOMM-UHFFFAOYSA-N
Compound name
2-butyl-3-(4-chlorophenyl)-5,6-dihydro-2H-imidazo[2,1-b][1,3]thiazol-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

310.09067 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 311.09795 170.9
[M+Na]+ 333.07989 181.0
[M-H]- 309.08339 175.2
[M+NH4]+ 328.12449 191.0
[M+K]+ 349.05383 174.9
[M+H-H2O]+ 293.08793 165.3
[M+HCOO]- 355.08887 180.4
[M+CH3COO]- 369.10452 182.2
[M+Na-2H]- 331.06534 169.5
[M]+ 310.09012 174.7
[M]- 310.09122 174.7
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

No patent data available for this compound.