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1,5-Diethyl-4-methyl-2,7-dioxabicyclo[2.2.1]heptane

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

1,5-Diethyl-4-methyl-2,7-dioxabicyclo[2.2.1]heptane
SpectraBase Compound ID 9WFMSN5ig4h
InChI InChI=1S/C10H18O2/c1-4-8-6-10(5-2)11-7-9(8,3)12-10/h8H,4-7H2,1-3H3/t8-,9-,10-/m1/s1
InChIKey UXDOQMTUGQXAAA-OPRDCNLKSA-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

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SpectraBase Spectrum ID 2oUaGnCe3TU
Name 1,5-Diethyl-4-methyl-2,7-dioxabicyclo[2.2.1]heptane
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/c1-4-8-6-10(5-2)11-7-9(8,3)12-10/h8H,4-7H2,1-3H3/t8-,9-,10-/m1/s1
InChIKey UXDOQMTUGQXAAA-OPRDCNLKSA-N
Molecular Weight 170.252 g/mol
SMILES [C@@]12(O[C@@](C)([C@@](C2)(CC)[H])CO1)CC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.981429