CID 75869

23890-27-9

Structural Information

Molecular Formula

C₁₀H₇N₂O₄S

SMILES

C1=CC2=C(C=CC(=C2O)[N+]#N)C(=C1)S(=O)(=O)O

InChI

InChI=1S/C10H6N2O4S/c11-12-8-5-4-6-7(10(8)13)2-1-3-9(6)17(14,15)16/h1-5H,(H-,13,14,15,16)/p+1

InChIKey

VJKZIQFVKMUTID-UHFFFAOYSA-O

Compound name

1-hydroxy-5-sulfonaphthalene-2-diazonium

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 23
Patents: 251.01265 Da
Monoisotopic Mass: 2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[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

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe