CID 13325830

3324-15-0

Structural Information

Molecular Formula
C5H7NO2S
SMILES
CC1(C(=O)NC(=O)S1)C
InChI
InChI=1S/C5H7NO2S/c1-5(2)3(7)6-4(8)9-5/h1-2H3,(H,6,7,8)
InChIKey
UWXNEBLQDNYFMR-UHFFFAOYSA-N
Compound name
5,5-dimethyl-1,3-thiazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

117
Patents

145.01974 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.027016 125.5
[M+Na]+ 168.008958 135.5
[M-H]- 144.012464 127.3
[M+NH4]+ 163.053563 149.6
[M+K]+ 183.982898 133.5
[M+H-H2O]+ 128.017000 121.9
[M+HCOO]- 190.017941 142.0
[M+CH3COO]- 204.033591 168.0
[M+Na-2H]- 165.994406 127.9
[M]+ 145.01919142 125.5
[M]- 145.02028858 125.5
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

patents stripe