CID 121552310

6-methoxy-3,4-dihydronaphthalene-2-sulfonyl chloride

Structural Information

Molecular Formula
C11H11ClO3S
SMILES
COC1=CC2=C(C=C1)C=C(CC2)S(=O)(=O)Cl
InChI
InChI=1S/C11H11ClO3S/c1-15-10-4-2-9-7-11(16(12,13)14)5-3-8(9)6-10/h2,4,6-7H,3,5H2,1H3
InChIKey
PBVIDHLUQCDCFF-UHFFFAOYSA-N
Compound name
6-methoxy-3,4-dihydronaphthalene-2-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.01175 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.01903 150.2
[M+Na]+ 281.00097 160.5
[M-H]- 257.00447 155.4
[M+NH4]+ 276.04557 170.0
[M+K]+ 296.97491 156.0
[M+H-H2O]+ 241.00901 145.9
[M+HCOO]- 303.00995 162.4
[M+CH3COO]- 317.02560 189.9
[M+Na-2H]- 278.98642 156.0
[M]+ 258.01120 155.8
[M]- 258.01230 155.8
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

No patent data available for this compound.