CID 11286883

2-oxo-1,3-oxazolidine-3-sulfonyl chloride

Structural Information

Molecular Formula
C3H4ClNO4S
SMILES
C1COC(=O)N1S(=O)(=O)Cl
InChI
InChI=1S/C3H4ClNO4S/c4-10(7,8)5-1-2-9-3(5)6/h1-2H2
InChIKey
WMZYIKJSQHNJNC-UHFFFAOYSA-N
Compound name
2-oxo-1,3-oxazolidine-3-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

64
Patents

184.95496 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.96224 130.9
[M+Na]+ 207.94418 141.3
[M-H]- 183.94768 134.7
[M+NH4]+ 202.98878 151.2
[M+K]+ 223.91812 140.4
[M+H-H2O]+ 167.95222 127.2
[M+HCOO]- 229.95316 143.2
[M+CH3COO]- 243.96881 171.5
[M+Na-2H]- 205.92963 135.1
[M]+ 184.95441 134.8
[M]- 184.95551 134.8
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