CID 19374444

4-(benzyloxy)benzene-1-sulfonamide

Structural Information

Molecular Formula

C₁₃H₁₃NO₃S

SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C13H13NO3S/c14-18(15,16)13-8-6-12(7-9-13)17-10-11-4-2-1-3-5-11/h1-9H,10H2,(H2,14,15,16)

InChIKey

AXTWZRIPELRWHW-UHFFFAOYSA-N

Compound name

4-phenylmethoxybenzenesulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 81
Patents: 263.0616 Da
Monoisotopic Mass: 2.4
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]+	264.06888	156.6
[M+Na]+	286.05082	169.2
[M+NH4]+	281.09542	164.5
[M+K]+	302.02476	161.1
[M-H]-	262.05432	160.4
[M+Na-2H]-	284.03627	165.2
[M]+	263.06105	159.9
[M]-	263.06215	159.9

Literature stripe

literature stripe

Patent stripe

patents stripe