CID 88263

19816-88-7

Structural Information

Molecular Formula

C₂₂H₂₂N₂O₂S

SMILES

CC1=CC=C(C=C1)S(=O)(=O)NN=C(CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C22H22N2O2S/c1-18-12-14-22(15-13-18)27(25,26)24-23-21(16-19-8-4-2-5-9-19)17-20-10-6-3-7-11-20/h2-15,24H,16-17H2,1H3

InChIKey

GDXUEUWCUUAZFM-UHFFFAOYSA-N

Compound name

N-(1,3-diphenylpropan-2-ylideneamino)-4-methylbenzenesulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 32
Patents: 378.1402 Da
Monoisotopic Mass: 4.6
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]+	379.14748	189.3
[M+Na]+	401.12942	202.7
[M+NH4]+	396.17402	197.0
[M+K]+	417.10336	192.1
[M-H]-	377.13292	196.5
[M+Na-2H]-	399.11487	200.7
[M]+	378.13965	193.8
[M]-	378.14075	193.8

Literature stripe

literature stripe

Patent stripe

patents stripe