CID 137965599

1-(2-chloroethyl)cyclopropane-1-sulfonyl chloride

Structural Information

Molecular Formula
C5H8Cl2O2S
SMILES
C1CC1(CCCl)S(=O)(=O)Cl
InChI
InChI=1S/C5H8Cl2O2S/c6-4-3-5(1-2-5)10(7,8)9/h1-4H2
InChIKey
ZOHRSULRLAGHAG-UHFFFAOYSA-N
Compound name
1-(2-chloroethyl)cyclopropane-1-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

201.9622 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.96948 130.0
[M+Na]+ 224.95142 140.6
[M-H]- 200.95492 134.4
[M+NH4]+ 219.99602 147.7
[M+K]+ 240.92536 136.7
[M+H-H2O]+ 184.95946 127.6
[M+HCOO]- 246.96040 138.8
[M+CH3COO]- 260.97605 180.8
[M+Na-2H]- 222.93687 135.7
[M]+ 201.96165 137.3
[M]- 201.96275 137.3
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.