CID 3078352

Brn 3552529

Structural Information

Molecular Formula
C12H16N2O2S
SMILES
CC1=CN(C2=C1C=C(C=C2)S(=O)(=O)N(C)C)C
InChI
InChI=1S/C12H16N2O2S/c1-9-8-14(4)12-6-5-10(7-11(9)12)17(15,16)13(2)3/h5-8H,1-4H3
InChIKey
QBZHGDVNLAQFGN-UHFFFAOYSA-N
Compound name
N,N,1,3-tetramethylindole-5-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

252.09325 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.100526 154.9
[M+Na]+ 275.082468 166.4
[M-H]- 251.085974 161.1
[M+NH4]+ 270.127073 175.5
[M+K]+ 291.056408 163.8
[M+H-H2O]+ 235.090510 149.1
[M+HCOO]- 297.091451 174.8
[M+CH3COO]- 311.107101 198.4
[M+Na-2H]- 273.067916 158.7
[M]+ 252.09270142 162.5
[M]- 252.09379858 162.5
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.