CID 51173550

4-methanesulfonyl-n-methoxy-n-methylbenzamide

Structural Information

Molecular Formula
C10H13NO4S
SMILES
CN(C(=O)C1=CC=C(C=C1)S(=O)(=O)C)OC
InChI
InChI=1S/C10H13NO4S/c1-11(15-2)10(12)8-4-6-9(7-5-8)16(3,13)14/h4-7H,1-3H3
InChIKey
UIDGYFLWPNOVTG-UHFFFAOYSA-N
Compound name
N-methoxy-N-methyl-4-methylsulfonylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

243.05653 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.063806 149.9
[M+Na]+ 266.045748 157.6
[M-H]- 242.049254 155.4
[M+NH4]+ 261.090353 168.2
[M+K]+ 282.019688 156.9
[M+H-H2O]+ 226.053790 143.6
[M+HCOO]- 288.054731 169.1
[M+CH3COO]- 302.070381 193.8
[M+Na-2H]- 264.031196 153.4
[M]+ 243.05598142 155.6
[M]- 243.05707858 155.6
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.