CID 107089

68083-31-8

Structural Information

Molecular Formula
C8H10O5S
SMILES
COC1=CC=CC=C1C(O)S(=O)(=O)O
InChI
InChI=1S/C8H10O5S/c1-13-7-5-3-2-4-6(7)8(9)14(10,11)12/h2-5,8-9H,1H3,(H,10,11,12)
InChIKey
RAJNNKDXHWGQBV-UHFFFAOYSA-N
Compound name
hydroxy-(2-methoxyphenyl)methanesulfonic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

218.02489 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.03217 143.8
[M+Na]+ 241.01411 153.5
[M+NH4]+ 236.05871 149.9
[M+K]+ 256.98805 148.9
[M-H]- 217.01761 142.4
[M+Na-2H]- 238.99956 147.5
[M]+ 218.02434 144.9
[M]- 218.02544 144.9
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.