CID 3685964

N,n-diethyl-2-hydrazinyl-5-nitrobenzene-1-sulfonamide

Structural Information

Molecular Formula
C10H16N4O4S
SMILES
CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NN
InChI
InChI=1S/C10H16N4O4S/c1-3-13(4-2)19(17,18)10-7-8(14(15)16)5-6-9(10)12-11/h5-7,12H,3-4,11H2,1-2H3
InChIKey
PQQHIXDRMKLSIK-UHFFFAOYSA-N
Compound name
N,N-diethyl-2-hydrazinyl-5-nitrobenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

288.08923 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.09651 158.3
[M+Na]+ 311.07845 166.2
[M+NH4]+ 306.12305 163.8
[M+K]+ 327.05239 164.2
[M-H]- 287.08195 160.7
[M+Na-2H]- 309.06390 162.3
[M]+ 288.08868 160.0
[M]- 288.08978 160.0
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