CID 137963736

5-cyclopropylthiophene-2-sulfonyl chloride

Structural Information

Molecular Formula
C7H7ClO2S2
SMILES
C1CC1C2=CC=C(S2)S(=O)(=O)Cl
InChI
InChI=1S/C7H7ClO2S2/c8-12(9,10)7-4-3-6(11-7)5-1-2-5/h3-5H,1-2H2
InChIKey
FYGAHRYSMWPRDN-UHFFFAOYSA-N
Compound name
5-cyclopropylthiophene-2-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.9576 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.96488 150.8
[M+Na]+ 244.94682 163.0
[M+NH4]+ 239.99142 160.4
[M+K]+ 260.92076 156.3
[M-H]- 220.95032 159.3
[M+Na-2H]- 242.93227 157.5
[M]+ 221.95705 157.1
[M]- 221.95815 157.1
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.