CID 54593981

[(4r)-2,5-dioxoimidazolidin-4-yl]methanesulfonyl chloride

Structural Information

Molecular Formula
C4H5ClN2O4S
SMILES
C([C@H]1C(=O)NC(=O)N1)S(=O)(=O)Cl
InChI
InChI=1S/C4H5ClN2O4S/c5-12(10,11)1-2-3(8)7-4(9)6-2/h2H,1H2,(H2,6,7,8,9)/t2-/m0/s1
InChIKey
QRPMKCBTJIZVKF-REOHCLBHSA-N
Compound name
[(4R)-2,5-dioxoimidazolidin-4-yl]methanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

211.96585 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.97313 140.1
[M+Na]+ 234.95507 150.1
[M-H]- 210.95857 139.1
[M+NH4]+ 229.99967 157.9
[M+K]+ 250.92901 145.5
[M+H-H2O]+ 194.96311 136.0
[M+HCOO]- 256.96405 148.6
[M+CH3COO]- 270.97970 172.7
[M+Na-2H]- 232.94052 141.3
[M]+ 211.96530 140.2
[M]- 211.96640 140.2
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