CID 551576

66710-66-5

Structural Information

Molecular Formula
C10H16N2O6S2
SMILES
C=CS(=O)(=O)CC(=O)NCCNC(=O)CS(=O)(=O)C=C
InChI
InChI=1S/C10H16N2O6S2/c1-3-19(15,16)7-9(13)11-5-6-12-10(14)8-20(17,18)4-2/h3-4H,1-2,5-8H2,(H,11,13)(H,12,14)
InChIKey
QWZOJDWOQYTACD-UHFFFAOYSA-N
Compound name
2-ethenylsulfonyl-N-[2-[(2-ethenylsulfonylacetyl)amino]ethyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2593
Patents

324.04498 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.05226 174.8
[M+Na]+ 347.03420 177.2
[M+NH4]+ 342.07880 176.3
[M+K]+ 363.00814 172.9
[M-H]- 323.03770 168.9
[M+Na-2H]- 345.01965 172.3
[M]+ 324.04443 173.5
[M]- 324.04553 173.5
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