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

*Links on SpectraBase are not permalinks.

(1R,2S,4S,5S)-1-ethyl-2,4-dimethyl-7,8-dioxabicyclo[3.2.1]octane

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

(1R,2S,4S,5S)-1-ethyl-2,4-dimethyl-7,8-dioxabicyclo[3.2.1]octane
SpectraBase Compound ID JUZDdz9A1QV
InChI InChI=1S/C10H18O2/c1-4-10-8(3)5-7(2)9(12-10)6-11-10/h7-9H,4-6H2,1-3H3/t7-,8-,9+,10+/m0/s1
InChIKey YMBRJMLOGNZRFY-AXTSPUMRSA-N
Mol Weight 170.25 g/mol
Molecular Formula C10H18O2
Exact Mass 170.13068 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID DdQVglYel5c
Name (1R,2S,4S,5S)-1-Ethyl-2,4-dimethyl-7,8-dioxabicyclo[3.2.1]octane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 170.130679818 u
Formula C10H18O2
InChI InChI=1S/C10H18O2/c1-4-10-8(3)5-7(2)9(12-10)6-11-10/h7-9H,4-6H2,1-3H3/t7-,8-,9+,10+/m0/s1
InChIKey YMBRJMLOGNZRFY-AXTSPUMRSA-N
Molecular Weight 170.252 g/mol
SMILES [C@]12(OC[C@]([C@](C[C@@]2(C)[H])(C)[H])(O1)[H])CC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.910168