CID 3848950

3-amino-n,n-diethyl-4-pyrrolidin-1-yl-benzenesulfonamide

Structural Information

Molecular Formula
C14H23N3O2S
SMILES
CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)N
InChI
InChI=1S/C14H23N3O2S/c1-3-17(4-2)20(18,19)12-7-8-14(13(15)11-12)16-9-5-6-10-16/h7-8,11H,3-6,9-10,15H2,1-2H3
InChIKey
QZQFAHSSGXNUQF-UHFFFAOYSA-N
Compound name
3-amino-N,N-diethyl-4-pyrrolidin-1-ylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

297.1511 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.15838 169.2
[M+Na]+ 320.14032 174.9
[M-H]- 296.14382 175.3
[M+NH4]+ 315.18492 185.3
[M+K]+ 336.11426 171.9
[M+H-H2O]+ 280.14836 161.6
[M+HCOO]- 342.14930 186.2
[M+CH3COO]- 356.16495 206.8
[M+Na-2H]- 318.12577 169.1
[M]+ 297.15055 169.7
[M]- 297.15165 169.7
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.