CID 88584

1-naphthalenediazonium, 2-hydroxy-4-sulfo-

Structural Information

Molecular Formula
C10H7N2O4S
SMILES
C1=CC=C2C(=C1)C(=CC(=C2[N+]#N)O)S(=O)(=O)O
InChI
InChI=1S/C10H6N2O4S/c11-12-10-7-4-2-1-3-6(7)9(5-8(10)13)17(14,15)16/h1-5H,(H-,13,14,15,16)/p+1
InChIKey
QHIBNGIZPPHJAT-UHFFFAOYSA-O
Compound name
2-hydroxy-4-sulfonaphthalene-1-diazonium
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

4
References

25
Patents

251.01265 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.01993 162.2
[M+Na]+ 274.00187 173.9
[M-H]- 250.00537 166.3
[M+NH4]+ 269.04647 178.0
[M+K]+ 289.97581 164.8
[M+H-H2O]+ 234.00991 152.8
[M+HCOO]- 296.01085 176.2
[M+CH3COO]- 310.02650 194.7
[M+Na-2H]- 271.98732 169.9
[M]+ 251.01210 158.8
[M]- 251.01320 158.8
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