CID 145866899

2138304-87-5

Structural Information

Molecular Formula
C10H15NO3S
SMILES
CNS(=O)(=O)C(COC)C1=CC=CC=C1
InChI
InChI=1S/C10H15NO3S/c1-11-15(12,13)10(8-14-2)9-6-4-3-5-7-9/h3-7,10-11H,8H2,1-2H3
InChIKey
BKSGXRGICNFWLV-UHFFFAOYSA-N
Compound name
2-methoxy-N-methyl-1-phenylethanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

229.07727 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.084546 148.9
[M+Na]+ 252.066488 155.4
[M-H]- 228.069994 152.5
[M+NH4]+ 247.111093 166.9
[M+K]+ 268.040428 153.2
[M+H-H2O]+ 212.074530 142.6
[M+HCOO]- 274.075471 167.2
[M+CH3COO]- 288.091121 188.6
[M+Na-2H]- 250.051936 153.3
[M]+ 229.07672142 152.2
[M]- 229.07781858 152.2
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

No patent data available for this compound.