CID 3593278

N-methoxy-n-methyl-2-(phenylsulfinyl)acetamide

Structural Information

Molecular Formula
C10H13NO3S
SMILES
CN(C(=O)CS(=O)C1=CC=CC=C1)OC
InChI
InChI=1S/C10H13NO3S/c1-11(14-2)10(12)8-15(13)9-6-4-3-5-7-9/h3-7H,8H2,1-2H3
InChIKey
RHSJKCKGJJSJPT-UHFFFAOYSA-N
Compound name
2-(benzenesulfinyl)-N-methoxy-N-methylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

227.06161 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.06889 148.5
[M+Na]+ 250.05083 154.6
[M-H]- 226.05433 153.4
[M+NH4]+ 245.09543 167.1
[M+K]+ 266.02477 154.0
[M+H-H2O]+ 210.05887 141.6
[M+HCOO]- 272.05981 167.8
[M+CH3COO]- 286.07546 191.9
[M+Na-2H]- 248.03628 150.3
[M]+ 227.06106 152.9
[M]- 227.06216 152.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.