CID 4205304

N-ethyl-4-(ethylamino)-3-nitrobenzenesulfonamide

Structural Information

Molecular Formula
C10H15N3O4S
SMILES
CCNC1=C(C=C(C=C1)S(=O)(=O)NCC)[N+](=O)[O-]
InChI
InChI=1S/C10H15N3O4S/c1-3-11-9-6-5-8(7-10(9)13(14)15)18(16,17)12-4-2/h5-7,11-12H,3-4H2,1-2H3
InChIKey
WPRCPDDNBSVKDA-UHFFFAOYSA-N
Compound name
N-ethyl-4-(ethylamino)-3-nitrobenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

273.07834 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.08562 155.5
[M+Na]+ 296.06756 164.9
[M+NH4]+ 291.11216 161.5
[M+K]+ 312.04150 161.6
[M-H]- 272.07106 157.7
[M+Na-2H]- 294.05301 159.9
[M]+ 273.07779 157.5
[M]- 273.07889 157.5
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.