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]+ 244.06381 149.9
[M+Na]+ 266.04575 157.6
[M-H]- 242.04925 155.4
[M+NH4]+ 261.09035 168.2
[M+K]+ 282.01969 156.9
[M+H-H2O]+ 226.05379 143.6
[M+HCOO]- 288.05473 169.1
[M+CH3COO]- 302.07038 193.8
[M+Na-2H]- 264.03120 153.4
[M]+ 243.05598 155.6
[M]- 243.05708 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.