CID 2369671

565172-42-1

Structural Information

Molecular Formula
C13H12FNO3S
SMILES
CN(C1=CC=C(C=C1)O)S(=O)(=O)C2=CC=CC=C2F
InChI
InChI=1S/C13H12FNO3S/c1-15(10-6-8-11(16)9-7-10)19(17,18)13-5-3-2-4-12(13)14/h2-9,16H,1H3
InChIKey
AZGSGUOTLVNEGI-UHFFFAOYSA-N
Compound name
2-fluoro-N-(4-hydroxyphenyl)-N-methylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

281.0522 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.059476 158.2
[M+Na]+ 304.041418 166.7
[M-H]- 280.044924 164.3
[M+NH4]+ 299.086023 174.1
[M+K]+ 320.015358 162.9
[M+H-H2O]+ 264.049460 150.2
[M+HCOO]- 326.050401 176.1
[M+CH3COO]- 340.066051 198.5
[M+Na-2H]- 302.026866 162.1
[M]+ 281.05165142 159.9
[M]- 281.05274858 159.9
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.