SpectraBase Spectrum ID |
GGZ2y7NXitX |
Name |
5-Hydroxy-2-(phenylsulfonyl)cyclopentadecanone |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
380.202130680 u |
Formula |
C21H32O4S |
InChI |
InChI=1S/C21H32O4S/c22-18-12-8-5-3-1-2-4-6-11-15-20(23)21(17-16-18)26(24,25)19-13-9-7-10-14-19/h7,9-10,13-14,18,21-22H,1-6,8,11-12,15-17H2 |
InChIKey |
IGLWIBVYVGUQFV-UHFFFAOYSA-N |
Molecular Weight |
380.543 g/mol |
SMILES |
C1C(CCCCCCCCCCC(C(C1)S(C1=CC=CC=C1)(=O)=O)=O)O |