CID 395339

Nsc699821

Structural Information

Molecular Formula
C22H20N2O4S2
SMILES
CS(=O)(=O)NC1=C(C2=CC=CC=C2C=C1)C3=C(C=CC4=CC=CC=C43)NS(=O)(=O)C
InChI
InChI=1S/C22H20N2O4S2/c1-29(25,26)23-19-13-11-15-7-3-5-9-17(15)21(19)22-18-10-6-4-8-16(18)12-14-20(22)24-30(2,27)28/h3-14,23-24H,1-2H3
InChIKey
YOKOWCMGIZHOOH-UHFFFAOYSA-N
Compound name
N-[1-[2-(methanesulfonamido)naphthalen-1-yl]naphthalen-2-yl]methanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

440.08646 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 441.09374 199.8
[M+Na]+ 463.07568 208.7
[M-H]- 439.07918 207.4
[M+NH4]+ 458.12028 210.8
[M+K]+ 479.04962 201.5
[M+H-H2O]+ 423.08372 191.6
[M+HCOO]- 485.08466 211.9
[M+CH3COO]- 499.10031 230.0
[M+Na-2H]- 461.06113 209.4
[M]+ 440.08591 205.5
[M]- 440.08701 205.5
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.