CID 3267140

N,n-(1,8-naphthalyl)hydroxylamine sodium salt

Structural Information

Molecular Formula
C12H6NO3
SMILES
C1=CC2=C3C(=C1)C(=O)N(C(=O)C3=CC=C2)[O-]
InChI
InChI=1S/C12H6NO3/c14-11-8-5-1-3-7-4-2-6-9(10(7)8)12(15)13(11)16/h1-6H/q-1
InChIKey
FOXBOODFOAODFX-UHFFFAOYSA-N
Compound name
2-oxidobenzo[de]isoquinoline-1,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

4
Patents

212.03477 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.04205 139.1
[M+Na]+ 235.02399 149.0
[M-H]- 211.02749 141.5
[M+NH4]+ 230.06859 158.3
[M+K]+ 250.99793 145.9
[M+H-H2O]+ 195.03203 134.3
[M+HCOO]- 257.03297 158.5
[M+CH3COO]- 271.04862 186.2
[M+Na-2H]- 233.00944 147.1
[M]+ 212.03422 139.0
[M]- 212.03532 139.0
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