CID 87312

Cyclohexanesulfenyl chloride

Structural Information

Molecular Formula
C6H11ClS
SMILES
C1CCC(CC1)SCl
InChI
InChI=1S/C6H11ClS/c7-8-6-4-2-1-3-5-6/h6H,1-5H2
InChIKey
XRFDWTWFFLOKAV-UHFFFAOYSA-N
Compound name
cyclohexyl thiohypochlorite
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

126
Patents

150.027 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.03428 127.7
[M+Na]+ 173.01622 134.1
[M-H]- 149.01972 130.8
[M+NH4]+ 168.06082 150.2
[M+K]+ 188.99016 131.2
[M+H-H2O]+ 133.02426 123.7
[M+HCOO]- 195.02520 139.1
[M+CH3COO]- 209.04085 171.4
[M+Na-2H]- 171.00167 130.6
[M]+ 150.02645 126.2
[M]- 150.02755 126.2
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