For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

(2R,6R)-1,2-o-(Methylethylidene)-4-(5'-methylhexane)-1,2,3-triol

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

(2R,6R)-1,2-o-(Methylethylidene)-4-(5'-methylhexane)-1,2,3-triol
SpectraBase Compound ID 8XLKpc7Ioxn
InChI InChI=1S/C10H20O3/c1-7(2)5-8(11)9-6-12-10(3,4)13-9/h7-9,11H,5-6H2,1-4H3/t8-,9?/m1/s1
InChIKey BJIBUHISHNJRCG-VEDVMXKPSA-N
Mol Weight 188.27 g/mol
Molecular Formula C10H20O3
Exact Mass 188.141245 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

Subscribe to view the full spectrum.

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID XxBCJ8nNti
Name (2R,6R)-1,2-o-(Methylethylidene)-4-(5'-methylhexane)-1,2,3-triol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 188.141244501 u
Formula C10H20O3
InChI InChI=1S/C10H20O3/c1-7(2)5-8(11)9-6-12-10(3,4)13-9/h7-9,11H,5-6H2,1-4H3/t8-,9?/m1/s1
InChIKey BJIBUHISHNJRCG-VEDVMXKPSA-N
Molecular Weight 188.267 g/mol
SMILES C1(OC(CO1)[C@@](CC(C)C)(O)[H])(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.982682