CID 3071739

Brn 5345936

Structural Information

Molecular Formula
C11H19N3O3S
SMILES
CN(C)CCCNS(=O)(=O)C1=C(C=CN=C1)OC
InChI
InChI=1S/C11H19N3O3S/c1-14(2)8-4-6-13-18(15,16)11-9-12-7-5-10(11)17-3/h5,7,9,13H,4,6,8H2,1-3H3
InChIKey
KOLKIBBJBCIELV-UHFFFAOYSA-N
Compound name
N-[3-(dimethylamino)propyl]-4-methoxypyridine-3-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

273.11472 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.12200 160.5
[M+Na]+ 296.10394 166.9
[M-H]- 272.10744 164.1
[M+NH4]+ 291.14854 176.0
[M+K]+ 312.07788 165.2
[M+H-H2O]+ 256.11198 152.6
[M+HCOO]- 318.11292 179.7
[M+CH3COO]- 332.12857 203.0
[M+Na-2H]- 294.08939 164.9
[M]+ 273.11417 166.1
[M]- 273.11527 166.1
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.