CID 71771972

905858-63-1

Structural Information

Molecular Formula
C14H15NO5S2
SMILES
CS(=O)(=O)N(C1=CC=CC=C1OC2=CC=CC=C2)S(=O)(=O)C
InChI
InChI=1S/C14H15NO5S2/c1-21(16,17)15(22(2,18)19)13-10-6-7-11-14(13)20-12-8-4-3-5-9-12/h3-11H,1-2H3
InChIKey
GLTNBGDWZIVPRX-UHFFFAOYSA-N
Compound name
N-methylsulfonyl-N-(2-phenoxyphenyl)methanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

341.03915 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.04643 175.5
[M+Na]+ 364.02837 182.9
[M-H]- 340.03187 183.2
[M+NH4]+ 359.07297 189.1
[M+K]+ 380.00231 179.1
[M+H-H2O]+ 324.03641 167.7
[M+HCOO]- 386.03735 189.1
[M+CH3COO]- 400.05300 207.6
[M+Na-2H]- 362.01382 180.6
[M]+ 341.03860 181.3
[M]- 341.03970 181.3
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.