CID 15562106

O-(4-nitrophenyl)hydroxylamine

Structural Information

Molecular Formula
C6H6N2O3
SMILES
C1=CC(=CC=C1[N+](=O)[O-])ON
InChI
InChI=1S/C6H6N2O3/c7-11-6-3-1-5(2-4-6)8(9)10/h1-4H,7H2
InChIKey
OOHKBWPOLBTKMR-UHFFFAOYSA-N
Compound name
O-(4-nitrophenyl)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

108
Patents

154.03784 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.04512 125.6
[M+Na]+ 177.02706 133.1
[M-H]- 153.03056 129.4
[M+NH4]+ 172.07166 145.3
[M+K]+ 193.00100 128.2
[M+H-H2O]+ 137.03510 124.4
[M+HCOO]- 199.03604 153.0
[M+CH3COO]- 213.05169 170.6
[M+Na-2H]- 175.01251 134.9
[M]+ 154.03729 123.4
[M]- 154.03839 123.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe