CID 6445243

Thioxanthene-2-sulfonamide, n,n-dimethyl-9-(3-(dimethylamino)propylidene)-, hydrochloride, (z)-

Structural Information

Molecular Formula
C20H24N2O2S2
SMILES
CN(C)CC/C=C/1\C2=CC=CC=C2SC3=C1C=C(C=C3)S(=O)(=O)N(C)C
InChI
InChI=1S/C20H24N2O2S2/c1-21(2)13-7-9-16-17-8-5-6-10-19(17)25-20-12-11-15(14-18(16)20)26(23,24)22(3)4/h5-6,8-12,14H,7,13H2,1-4H3/b16-9+
InChIKey
WRNCYLBLBQRLFM-CXUHLZMHSA-N
Compound name
(9E)-9-[3-(dimethylamino)propylidene]-N,N-dimethylthioxanthene-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

388.12793 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 389.13521 186.7
[M+Na]+ 411.11715 197.6
[M+NH4]+ 406.16175 195.2
[M+K]+ 427.09109 186.9
[M-H]- 387.12065 190.8
[M+Na-2H]- 409.10260 192.2
[M]+ 388.12738 190.4
[M]- 388.12848 190.4
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.