CID 165868622

2247105-29-7

Structural Information

Molecular Formula
C9H11ClO5S
SMILES
COCOC1=C(C=CC(=C1)S(=O)(=O)Cl)OC
InChI
InChI=1S/C9H11ClO5S/c1-13-6-15-9-5-7(16(10,11)12)3-4-8(9)14-2/h3-5H,6H2,1-2H3
InChIKey
QEAANLJREMPJGM-UHFFFAOYSA-N
Compound name
4-methoxy-3-(methoxymethoxy)benzenesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

266.0016 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.00888 150.1
[M+Na]+ 288.99082 160.3
[M-H]- 264.99432 154.8
[M+NH4]+ 284.03542 168.4
[M+K]+ 304.96476 157.5
[M+H-H2O]+ 248.99886 145.5
[M+HCOO]- 310.99980 164.9
[M+CH3COO]- 325.01545 190.2
[M+Na-2H]- 286.97627 154.6
[M]+ 266.00105 160.1
[M]- 266.00215 160.1
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.