CID 55279540

5-hydroxynaphthalene-1-sulfonylchloride

Structural Information

Molecular Formula
C10H7ClO3S
SMILES
C1=CC2=C(C=CC=C2S(=O)(=O)Cl)C(=C1)O
InChI
InChI=1S/C10H7ClO3S/c11-15(13,14)10-6-2-3-7-8(10)4-1-5-9(7)12/h1-6,12H
InChIKey
AENXAJMTMZFKKA-UHFFFAOYSA-N
Compound name
5-hydroxynaphthalene-1-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

241.98044 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.98772 144.5
[M+Na]+ 264.96966 155.8
[M-H]- 240.97316 148.9
[M+NH4]+ 260.01426 164.3
[M+K]+ 280.94360 150.5
[M+H-H2O]+ 224.97770 140.7
[M+HCOO]- 286.97864 157.0
[M+CH3COO]- 300.99429 184.0
[M+Na-2H]- 262.95511 151.3
[M]+ 241.97989 149.4
[M]- 241.98099 149.4
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

No patent data available for this compound.