CID 206245

Thiazole, 4,5-dihydro-2-(1-methylethyl)-

Structural Information

Molecular Formula
C6H11NS
SMILES
CC(C)C1=NCCS1
InChI
InChI=1S/C6H11NS/c1-5(2)6-7-3-4-8-6/h5H,3-4H2,1-2H3
InChIKey
HTSOMKXWOBFXMF-UHFFFAOYSA-N
Compound name
2-propan-2-yl-4,5-dihydro-1,3-thiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

73
Patents

129.06122 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.06850 126.7
[M+Na]+ 152.05044 137.2
[M+NH4]+ 147.09504 136.4
[M+K]+ 168.02438 131.2
[M-H]- 128.05394 128.3
[M+Na-2H]- 150.03589 131.5
[M]+ 129.06067 129.0
[M]- 129.06177 129.0
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

patents stripe