CID 205800

Thiazole, 4,5-dihydro-2-ethyl-5-methyl-

Structural Information

Molecular Formula
C6H11NS
SMILES
CCC1=NCC(S1)C
InChI
InChI=1S/C6H11NS/c1-3-6-7-4-5(2)8-6/h5H,3-4H2,1-2H3
InChIKey
USVOBUURUUPYAZ-UHFFFAOYSA-N
Compound name
2-ethyl-5-methyl-4,5-dihydro-1,3-thiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

129.06122 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.06850 126.5
[M+Na]+ 152.05044 137.7
[M+NH4]+ 147.09504 136.3
[M+K]+ 168.02438 131.0
[M-H]- 128.05394 128.3
[M+Na-2H]- 150.03589 131.3
[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

No literature data available for this compound.

Patent stripe

No patent data available for this compound.