| SpectraBase Spectrum ID |
L44yvfpDoyH |
| Name |
2-Butanol, 1-(2-nitrophenoxy)-, 4-methylbenzenesulfonate (ester), (.+-.)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
365.093308504 u |
| Formula |
C17H19NO6S |
| InChI |
InChI=1S/C17H19NO6S/c1-3-14(12-23-17-7-5-4-6-16(17)18(19)20)24-25(21,22)15-10-8-13(2)9-11-15/h4-11,14H,3,12H2,1-2H3 |
| InChIKey |
YSQDWIGZXMJIIU-UHFFFAOYSA-N |
| Molecular Weight |
365.400 g/mol |
| SMILES |
C(OS(C=1C=CC(=CC1)C)(=O)=O)(COC=1C(N(=O)=O)=CC=CC1)CC |
