CID 132146770

Nitroso-dapsone

Structural Information

Molecular Formula
C12H10N2O3S
SMILES
C1=CC(=CC=C1N)S(=O)(=O)C2=CC=C(C=C2)N=O
InChI
InChI=1S/C12H10N2O3S/c13-9-1-5-11(6-2-9)18(16,17)12-7-3-10(14-15)4-8-12/h1-8H,13H2
InChIKey
UAQFAHXMXOCEAD-UHFFFAOYSA-N
Compound name
4-(4-nitrosophenyl)sulfonylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

262.0412 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.04848 154.9
[M+Na]+ 285.03042 163.9
[M-H]- 261.03392 163.2
[M+NH4]+ 280.07502 171.7
[M+K]+ 301.00436 160.0
[M+H-H2O]+ 245.03846 147.3
[M+HCOO]- 307.03940 177.1
[M+CH3COO]- 321.05505 198.1
[M+Na-2H]- 283.01587 160.8
[M]+ 262.04065 157.2
[M]- 262.04175 157.2
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.