CID 87031

5-hydroxynaphthalene-1-sulfonamide

Structural Information

Molecular Formula
C10H9NO3S
SMILES
C1=CC2=C(C=CC=C2S(=O)(=O)N)C(=C1)O
InChI
InChI=1S/C10H9NO3S/c11-15(13,14)10-6-2-3-7-8(10)4-1-5-9(7)12/h1-6,12H,(H2,11,13,14)
InChIKey
NFVBVKHGDDDCEA-UHFFFAOYSA-N
Compound name
5-hydroxynaphthalene-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

116
Patents

223.03032 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.037596 143.2
[M+Na]+ 246.019538 152.9
[M-H]- 222.023044 146.7
[M+NH4]+ 241.064143 162.1
[M+K]+ 261.993478 148.5
[M+H-H2O]+ 206.027580 138.0
[M+HCOO]- 268.028521 160.4
[M+CH3COO]- 282.044171 184.7
[M+Na-2H]- 244.004986 149.8
[M]+ 223.02977142 144.2
[M]- 223.03086858 144.2
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