CID 18965206

148312-56-5

Structural Information

Molecular Formula
C8H15NO4S
SMILES
CC(C)(C)OC(=O)N1CCS(=O)(=O)C1
InChI
InChI=1S/C8H15NO4S/c1-8(2,3)13-7(10)9-4-5-14(11,12)6-9/h4-6H2,1-3H3
InChIKey
AQKUXLUTDNNRLD-UHFFFAOYSA-N
Compound name
tert-butyl 1,1-dioxo-1,3-thiazolidine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

221.07217 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.07945 146.2
[M+Na]+ 244.06139 154.6
[M-H]- 220.06489 148.8
[M+NH4]+ 239.10599 167.8
[M+K]+ 260.03533 154.2
[M+H-H2O]+ 204.06943 142.3
[M+HCOO]- 266.07037 161.3
[M+CH3COO]- 280.08602 181.0
[M+Na-2H]- 242.04684 148.5
[M]+ 221.07162 149.6
[M]- 221.07272 149.6
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