CID 145671

1,4-bis(ethenylsulfonyl)butane

Structural Information

Molecular Formula
C8H14O4S2
SMILES
C=CS(=O)(=O)CCCCS(=O)(=O)C=C
InChI
InChI=1S/C8H14O4S2/c1-3-13(9,10)7-5-6-8-14(11,12)4-2/h3-4H,1-2,5-8H2
InChIKey
HGLPVMBQJHDEJY-UHFFFAOYSA-N
Compound name
1,4-bis(ethenylsulfonyl)butane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

204
Patents

238.03336 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.04064 151.0
[M+Na]+ 261.02258 158.7
[M-H]- 237.02608 150.8
[M+NH4]+ 256.06718 168.8
[M+K]+ 276.99652 153.9
[M+H-H2O]+ 221.03062 145.9
[M+HCOO]- 283.03156 161.7
[M+CH3COO]- 297.04721 185.3
[M+Na-2H]- 259.00803 153.0
[M]+ 238.03281 155.9
[M]- 238.03391 155.9
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