CID 24846269

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

Structural Information

Molecular Formula
C18H26N4O2S
SMILES
CCN(CC)CCN(CC1=CC=CC=N1)S(=O)(=O)C2=CC=C(C=C2)N
InChI
InChI=1S/C18H26N4O2S/c1-3-21(4-2)13-14-22(15-17-7-5-6-12-20-17)25(23,24)18-10-8-16(19)9-11-18/h5-12H,3-4,13-15,19H2,1-2H3
InChIKey
ODROVHHDRGXIQY-UHFFFAOYSA-N
Compound name
4-amino-N-[2-(diethylamino)ethyl]-N-(pyridin-2-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 185.8
[M+Na]+ 385.16686 190.0
[M-H]- 361.17036 192.6
[M+NH4]+ 380.21146 197.2
[M+K]+ 401.14080 186.6
[M+H-H2O]+ 345.17490 175.7
[M+HCOO]- 407.17584 204.8
[M+CH3COO]- 421.19149 225.3
[M+Na-2H]- 383.15231 188.7
[M]+ 362.17709 189.4
[M]- 362.17819 189.4
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.