CID 242307

6327-46-4

Structural Information

Molecular Formula
C15H18N2O4S
SMILES
C1CCC(CC1)C2=C(ONC2=O)NS(=O)(=O)C3=CC=CC=C3
InChI
InChI=1S/C15H18N2O4S/c18-14-13(11-7-3-1-4-8-11)15(21-16-14)17-22(19,20)12-9-5-2-6-10-12/h2,5-6,9-11,17H,1,3-4,7-8H2,(H,16,18)
InChIKey
VWQJROFHLBAQNQ-UHFFFAOYSA-N
Compound name
N-(4-cyclohexyl-3-oxo-1,2-oxazol-5-yl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

322.09872 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.10600 171.0
[M+Na]+ 345.08794 177.2
[M-H]- 321.09144 178.7
[M+NH4]+ 340.13254 183.4
[M+K]+ 361.06188 173.4
[M+H-H2O]+ 305.09598 163.7
[M+HCOO]- 367.09692 185.4
[M+CH3COO]- 381.11257 199.9
[M+Na-2H]- 343.07339 173.5
[M]+ 322.09817 169.3
[M]- 322.09927 169.3
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.