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(1S,5R)-1,5-Dimethyl-8-oxabicyclo[3.2.1]oct-3-en-6-.alpha.-ol
SpectraBase Compound ID Lk7ofJSdKR9
InChI InChI=1S/C9H14O2/c1-8-4-3-5-9(2,11-8)7(10)6-8/h3,5,7,10H,4,6H2,1-2H3/t7-,8+,9-/m1/s1
InChIKey MYHSQUXPKFWTFK-HRDYMLBCSA-N
Mol Weight 154.21 g/mol
Molecular Formula C9H14O2
Exact Mass 154.09938 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6fT3r7TX7NN
Name (1S,5R)-1,5-Dimethyl-8-oxabicyclo[3.2.1]oct-3-en-6-.alpha.-ol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 154.099379689 u
Formula C9H14O2
InChI InChI=1S/C9H14O2/c1-8-4-3-5-9(2,11-8)7(10)6-8/h3,5,7,10H,4,6H2,1-2H3/t7-,8+,9-/m1/s1
InChIKey MYHSQUXPKFWTFK-HRDYMLBCSA-N
Molecular Weight 154.209 g/mol
SMILES [C@]12(O[C@](C)(C[C@]2(O)[H])CC=C1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.843368