CID 201000

N,n-diethyl-p-hydroxybenzenesulfonamide dimethyl phosphate

Structural Information

Molecular Formula
C12H20NO6PS
SMILES
CCN(CC)S(=O)(=O)C1=CC=C(C=C1)OP(=O)(OC)OC
InChI
InChI=1S/C12H20NO6PS/c1-5-13(6-2)21(15,16)12-9-7-11(8-10-12)19-20(14,17-3)18-4/h7-10H,5-6H2,1-4H3
InChIKey
XBUDJPNXMUOKPC-UHFFFAOYSA-N
Compound name
[4-(diethylsulfamoyl)phenyl] dimethyl phosphate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

337.0749 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.08218 172.6
[M+Na]+ 360.06412 180.1
[M+NH4]+ 355.10872 176.9
[M+K]+ 376.03806 176.1
[M-H]- 336.06762 171.0
[M+Na-2H]- 358.04957 175.6
[M]+ 337.07435 173.3
[M]- 337.07545 173.3
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.