CID 208531

N-(3-diethylaminopropyl)-p-ethoxybenzenesulfonamide

Structural Information

Molecular Formula
C15H26N2O3S
SMILES
CCN(CC)CCCNS(=O)(=O)C1=CC=C(C=C1)OCC
InChI
InChI=1S/C15H26N2O3S/c1-4-17(5-2)13-7-12-16-21(18,19)15-10-8-14(9-11-15)20-6-3/h8-11,16H,4-7,12-13H2,1-3H3
InChIKey
ZBDVLXRSLGRTTC-UHFFFAOYSA-N
Compound name
N-[3-(diethylamino)propyl]-4-ethoxybenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

314.1664 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.17368 174.1
[M+Na]+ 337.15562 178.7
[M-H]- 313.15912 178.3
[M+NH4]+ 332.20022 189.2
[M+K]+ 353.12956 176.2
[M+H-H2O]+ 297.16366 166.2
[M+HCOO]- 359.16460 193.2
[M+CH3COO]- 373.18025 212.4
[M+Na-2H]- 335.14107 176.5
[M]+ 314.16585 180.7
[M]- 314.16695 180.7
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.