CID 155858638

5-ethyl-5-methyl-1,3-thiazolidin-2-one

Structural Information

Molecular Formula
C6H11NOS
SMILES
CCC1(CNC(=O)S1)C
InChI
InChI=1S/C6H11NOS/c1-3-6(2)4-7-5(8)9-6/h3-4H2,1-2H3,(H,7,8)
InChIKey
XQIUQKGXMHJBID-UHFFFAOYSA-N
Compound name
5-ethyl-5-methyl-1,3-thiazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

145.05614 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.06342 128.5
[M+Na]+ 168.04536 137.1
[M-H]- 144.04886 129.8
[M+NH4]+ 163.08996 152.5
[M+K]+ 184.01930 135.0
[M+H-H2O]+ 128.05340 124.4
[M+HCOO]- 190.05434 144.3
[M+CH3COO]- 204.06999 168.8
[M+Na-2H]- 166.03081 130.7
[M]+ 145.05559 127.7
[M]- 145.05669 127.7
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.