CID 103843

4-amino-n-(2-ethylhexyl)benzenesulfonamide

Structural Information

Molecular Formula
C14H24N2O2S
SMILES
CCCCC(CC)CNS(=O)(=O)C1=CC=C(C=C1)N
InChI
InChI=1S/C14H24N2O2S/c1-3-5-6-12(4-2)11-16-19(17,18)14-9-7-13(15)8-10-14/h7-10,12,16H,3-6,11,15H2,1-2H3
InChIKey
HHEXVLXMZIVFSS-UHFFFAOYSA-N
Compound name
4-amino-N-(2-ethylhexyl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

284.15585 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.16313 166.8
[M+Na]+ 307.14507 171.6
[M-H]- 283.14857 169.2
[M+NH4]+ 302.18967 182.2
[M+K]+ 323.11901 167.5
[M+H-H2O]+ 267.15311 159.6
[M+HCOO]- 329.15405 183.7
[M+CH3COO]- 343.16970 204.2
[M+Na-2H]- 305.13052 167.9
[M]+ 284.15530 168.6
[M]- 284.15640 168.6
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

patents stripe