CID 82379

10128-55-9

Structural Information

Molecular Formula
C24H16N2O4S
SMILES
C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)NC3=CC=CC=C3C4=NC5=CC=CC=C5C(=O)O4
InChI
InChI=1S/C24H16N2O4S/c27-24-20-10-4-5-11-21(20)25-23(30-24)19-9-3-6-12-22(19)26-31(28,29)18-14-13-16-7-1-2-8-17(16)15-18/h1-15,26H
InChIKey
SYRKOPHMPLPLPQ-UHFFFAOYSA-N
Compound name
N-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]naphthalene-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

6
References

84
Patents

428.08307 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 429.09035 199.6
[M+Na]+ 451.07229 210.2
[M-H]- 427.07579 210.9
[M+NH4]+ 446.11689 208.2
[M+K]+ 467.04623 204.4
[M+H-H2O]+ 411.08033 188.8
[M+HCOO]- 473.08127 216.0
[M+CH3COO]- 487.09692 209.6
[M+Na-2H]- 449.05774 209.1
[M]+ 428.08252 204.9
[M]- 428.08362 204.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe