CID 3059699

Imidazo(2,1-b)thiazole, 5,6-dihydro-6,6-dimethyl-3-phenyl-, hydrobromide

Structural Information

Molecular Formula
C13H14N2S
SMILES
CC1(CN2C(=CSC2=N1)C3=CC=CC=C3)C
InChI
InChI=1S/C13H14N2S/c1-13(2)9-15-11(8-16-12(15)14-13)10-6-4-3-5-7-10/h3-8H,9H2,1-2H3
InChIKey
HKKQVHLBHDWXSV-UHFFFAOYSA-N
Compound name
6,6-dimethyl-3-phenyl-5H-imidazo[2,1-b][1,3]thiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

230.08777 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.09505 150.3
[M+Na]+ 253.07699 161.7
[M-H]- 229.08049 156.7
[M+NH4]+ 248.12159 173.6
[M+K]+ 269.05093 157.7
[M+H-H2O]+ 213.08503 144.2
[M+HCOO]- 275.08597 168.0
[M+CH3COO]- 289.10162 164.1
[M+Na-2H]- 251.06244 152.1
[M]+ 230.08722 153.2
[M]- 230.08832 153.2
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

No patent data available for this compound.