CID 81560

Methanesulfonic anhydride

Structural Information

Molecular Formula
C2H6O5S2
SMILES
CS(=O)(=O)OS(=O)(=O)C
InChI
InChI=1S/C2H6O5S2/c1-8(3,4)7-9(2,5)6/h1-2H3
InChIKey
IZDROVVXIHRYMH-UHFFFAOYSA-N
Compound name
methylsulfonyl methanesulfonate
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

10
References

21566
Patents

173.96567 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.972946 130.5
[M+Na]+ 196.954888 139.8
[M-H]- 172.958394 131.2
[M+NH4]+ 191.999493 150.8
[M+K]+ 212.928828 138.1
[M+H-H2O]+ 156.962930 126.2
[M+HCOO]- 218.963871 142.9
[M+CH3COO]- 232.979521 171.4
[M+Na-2H]- 194.940336 135.3
[M]+ 173.96512142 136.0
[M]- 173.96621858 136.0
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