CID 684820

23224-09-1

Structural Information

Molecular Formula
C12H12N2S
SMILES
CC1=CC=C(C=C1)C2=CSC3=NCCN23
InChI
InChI=1S/C12H12N2S/c1-9-2-4-10(5-3-9)11-8-15-12-13-6-7-14(11)12/h2-5,8H,6-7H2,1H3
InChIKey
ZSLGTNCOVGLOAD-UHFFFAOYSA-N
Compound name
3-(4-methylphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

8
Patents

216.07211 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.079386 146.6
[M+Na]+ 239.061328 157.6
[M-H]- 215.064834 152.8
[M+NH4]+ 234.105933 168.4
[M+K]+ 255.035268 153.7
[M+H-H2O]+ 199.069370 140.3
[M+HCOO]- 261.070311 164.6
[M+CH3COO]- 275.085961 160.4
[M+Na-2H]- 237.046776 147.6
[M]+ 216.07156142 148.8
[M]- 216.07265858 148.8
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

No patent data available for this compound.