CID 137965671

(1z)-buta-1,3-diene-1-sulfonyl fluoride

Structural Information

Molecular Formula
C4H5FO2S
SMILES
C=C/C=C\S(=O)(=O)F
InChI
InChI=1S/C4H5FO2S/c1-2-3-4-8(5,6)7/h2-4H,1H2/b4-3-
InChIKey
AIIIUATWZPUYHX-ARJAWSKDSA-N
Compound name
(1Z)-buta-1,3-diene-1-sulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

135.99944 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.006716 120.8
[M+Na]+ 158.988658 130.4
[M-H]- 134.992164 120.6
[M+NH4]+ 154.033263 143.2
[M+K]+ 174.962598 128.0
[M+H-H2O]+ 118.996700 116.1
[M+HCOO]- 180.997641 138.4
[M+CH3COO]- 195.013291 167.7
[M+Na-2H]- 156.974106 125.4
[M]+ 135.99889142 121.7
[M]- 135.99998858 121.7
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

No patent data available for this compound.