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

175
Patents

238.03336 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.040636 151.0
[M+Na]+ 261.022578 158.7
[M-H]- 237.026084 150.8
[M+NH4]+ 256.067183 168.8
[M+K]+ 276.996518 153.9
[M+H-H2O]+ 221.030620 145.9
[M+HCOO]- 283.031561 161.7
[M+CH3COO]- 297.047211 185.3
[M+Na-2H]- 259.008026 153.0
[M]+ 238.03281142 155.9
[M]- 238.03390858 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