SpectraBase Spectrum ID |
JsJrMxnhxPe |
Name |
Arteether, 3-desoxy- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
296.198759378 u |
Formula |
C17H28O4 |
InChI |
InChI=1S/C17H28O4/c1-5-18-14-11(3)13-7-6-10(2)12-8-9-16(4)20-15(19-14)17(12,13)21-16/h10-15H,5-9H2,1-4H3 |
InChIKey |
QNIBYSJOIWYARP-UHFFFAOYSA-N |
Molecular Weight |
296.407 g/mol |
SMILES |
C12C(C(OC3C22C(C(CC1)C)CCC(O2)(O3)C)OCC)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.849224 |