CID 18517206

Prop-1-ene-2-sulfonyl chloride

Structural Information

Molecular Formula
C3H5ClO2S
SMILES
CC(=C)S(=O)(=O)Cl
InChI
InChI=1S/C3H5ClO2S/c1-3(2)7(4,5)6/h1H2,2H3
InChIKey
XMTDOMOVYBJFSU-UHFFFAOYSA-N
Compound name
prop-1-ene-2-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

75
Patents

139.96988 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.97716 120.2
[M+Na]+ 162.95910 130.2
[M-H]- 138.96260 121.7
[M+NH4]+ 158.00370 143.3
[M+K]+ 178.93304 127.6
[M+H-H2O]+ 122.96714 117.7
[M+HCOO]- 184.96808 133.5
[M+CH3COO]- 198.98373 168.3
[M+Na-2H]- 160.94455 124.4
[M]+ 139.96933 123.8
[M]- 139.97043 123.8
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