CID 161785

4,4'-sulfonylbis(n,n-dimethylbenzenamine)

Structural Information

Molecular Formula
C16H20N2O2S
SMILES
CN(C)C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)N(C)C
InChI
InChI=1S/C16H20N2O2S/c1-17(2)13-5-9-15(10-6-13)21(19,20)16-11-7-14(8-12-16)18(3)4/h5-12H,1-4H3
InChIKey
PLJHQVSJDMKAFP-UHFFFAOYSA-N
Compound name
4-[4-(dimethylamino)phenyl]sulfonyl-N,N-dimethylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

25
Patents

304.12454 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.13182 169.7
[M+Na]+ 327.11376 181.9
[M+NH4]+ 322.15836 177.8
[M+K]+ 343.08770 174.0
[M-H]- 303.11726 174.9
[M+Na-2H]- 325.09921 178.6
[M]+ 304.12399 173.5
[M]- 304.12509 173.5
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

patents stripe