CID 24846273

Sulfanilamide, n(sup 1)-(2-diethylaminoethyl)-n(sup 1)-(4-pyridylmethyl)-, dihydrochloride

Structural Information

Molecular Formula
C18H26N4O2S
SMILES
CCN(CC)CCN(CC1=CC=NC=C1)S(=O)(=O)C2=CC=C(C=C2)N
InChI
InChI=1S/C18H26N4O2S/c1-3-21(4-2)13-14-22(15-16-9-11-20-12-10-16)25(23,24)18-7-5-17(19)6-8-18/h5-12H,3-4,13-15,19H2,1-2H3
InChIKey
VCGBJIKEXPMLKC-UHFFFAOYSA-N
Compound name
4-amino-N-[2-(diethylamino)ethyl]-N-(pyridin-4-ylmethyl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

362.17764 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.18492 184.7
[M+Na]+ 385.16686 194.1
[M+NH4]+ 380.21146 190.8
[M+K]+ 401.14080 186.7
[M-H]- 361.17036 188.9
[M+Na-2H]- 383.15231 192.1
[M]+ 362.17709 187.5
[M]- 362.17819 187.5
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.