CID 5275160

N-(2-chlorophenyl)-2-[2-(1-naphthyl)phenyl]sulfinyl-acetamide

Structural Information

Molecular Formula
C24H18ClNO2S
SMILES
C1=CC=C2C(=C1)C=CC=C2C3=CC=CC=C3S(=O)CC(=O)NC4=CC=CC=C4Cl
InChI
InChI=1S/C24H18ClNO2S/c25-21-13-4-5-14-22(21)26-24(27)16-29(28)23-15-6-3-11-20(23)19-12-7-9-17-8-1-2-10-18(17)19/h1-15H,16H2,(H,26,27)
InChIKey
DWPYDSBEPHMJHI-UHFFFAOYSA-N
Compound name
N-(2-chlorophenyl)-2-(2-naphthalen-1-ylphenyl)sulfinylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

419.07468 Da
Monoisotopic Mass

6.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 420.08196 196.2
[M+Na]+ 442.06390 203.6
[M-H]- 418.06740 206.3
[M+NH4]+ 437.10850 207.8
[M+K]+ 458.03784 195.6
[M+H-H2O]+ 402.07194 187.5
[M+HCOO]- 464.07288 208.4
[M+CH3COO]- 478.08853 205.5
[M+Na-2H]- 440.04935 198.4
[M]+ 419.07413 200.2
[M]- 419.07523 200.2
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.