CID 4868371

5,6,7,8-tetrahydronaphthalene-2-sulfonyl chloride

Structural Information

Molecular Formula
C10H11ClO2S
SMILES
C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)Cl
InChI
InChI=1S/C10H11ClO2S/c11-14(12,13)10-6-5-8-3-1-2-4-9(8)7-10/h5-7H,1-4H2
InChIKey
FNEIMPFRVQQOMV-UHFFFAOYSA-N
Compound name
5,6,7,8-tetrahydronaphthalene-2-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

173
Patents

230.01683 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.02411 145.2
[M+Na]+ 253.00605 158.6
[M+NH4]+ 248.05065 155.2
[M+K]+ 268.97999 149.4
[M-H]- 229.00955 147.6
[M+Na-2H]- 250.99150 151.5
[M]+ 230.01628 148.7
[M]- 230.01738 148.7
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

patents stripe