CID 9823454

Bb-78485

Structural Information

Molecular Formula
C23H20N2O4S
SMILES
C1=CC=C2C=C(C=CC2=C1)C[C@H](C(=O)NO)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3
InChI
InChI=1S/C23H20N2O4S/c26-23(24-27)22(14-16-9-10-17-5-1-3-7-19(17)13-16)25-30(28,29)21-12-11-18-6-2-4-8-20(18)15-21/h1-13,15,22,25,27H,14H2,(H,24,26)/t22-/m1/s1
InChIKey
MMOUXLMPQFMDRD-JOCHJYFZSA-N
Compound name
(2R)-N-hydroxy-3-naphthalen-2-yl-2-(naphthalen-2-ylsulfonylamino)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

19
Patents

420.11438 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 421.12166 193.3
[M+Na]+ 443.10360 198.9
[M-H]- 419.10710 199.7
[M+NH4]+ 438.14820 203.6
[M+K]+ 459.07754 193.2
[M+H-H2O]+ 403.11164 184.7
[M+HCOO]- 465.11258 208.5
[M+CH3COO]- 479.12823 225.7
[M+Na-2H]- 441.08905 201.1
[M]+ 420.11383 196.0
[M]- 420.11493 196.0
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.