CID 4121162

2-hydroxy-4-sulfo-1-naphthalenediazonium chloride

Structural Information

Molecular Formula
C10H8N2O4S
SMILES
C1=CC=C2C(=C1)C(=CC(=C2N=N)O)S(=O)(=O)O
InChI
InChI=1S/C10H8N2O4S/c11-12-10-7-4-2-1-3-6(7)9(5-8(10)13)17(14,15)16/h1-5,11,13H,(H,14,15,16)
InChIKey
ZMQUJOAYCWMNSD-UHFFFAOYSA-N
Compound name
4-diazenyl-3-hydroxynaphthalene-1-sulfonic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

252.02048 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.02776 148.1
[M+Na]+ 275.00970 157.6
[M-H]- 251.01320 152.1
[M+NH4]+ 270.05430 165.6
[M+K]+ 290.98364 153.6
[M+H-H2O]+ 235.01774 142.3
[M+HCOO]- 297.01868 167.1
[M+CH3COO]- 311.03433 193.2
[M+Na-2H]- 272.99515 156.0
[M]+ 252.01993 150.4
[M]- 252.02103 150.4
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