CID 388550

57903-15-8

Structural Information

Molecular Formula
C8H11NO7S
SMILES
CS(=O)(=O)CCOC(=O)ON1C(=O)CCC1=O
InChI
InChI=1S/C8H11NO7S/c1-17(13,14)5-4-15-8(12)16-9-6(10)2-3-7(9)11/h2-5H2,1H3
InChIKey
KSMLVLJMKBLJJL-UHFFFAOYSA-N
Compound name
(2,5-dioxopyrrolidin-1-yl) 2-methylsulfonylethyl carbonate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

60
Patents

265.02563 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.03291 152.7
[M+Na]+ 288.01485 160.8
[M-H]- 264.01835 155.3
[M+NH4]+ 283.05945 170.0
[M+K]+ 303.98879 160.4
[M+H-H2O]+ 248.02289 147.5
[M+HCOO]- 310.02383 168.8
[M+CH3COO]- 324.03948 188.2
[M+Na-2H]- 286.00030 153.6
[M]+ 265.02508 159.0
[M]- 265.02618 159.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe