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1-Deutero-6-hydroxy-9-oxabicyclo[3.3.1]nonan-2-one
SpectraBase Compound ID BdBxAv2UD9s
InChI InChI=1S/C8H12O3/c9-5-1-3-7-6(10)2-4-8(5)11-7/h5,7-9H,1-4H2/t5-,7+,8-/m1/s1/i7D
InChIKey GUKXZHWRPPXJQD-PFBFRKNPSA-N
Mol Weight 157.19 g/mol
Molecular Formula C8H11DO3
Exact Mass 157.084921 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HeRmkNlButM
Name 1-Deutero-6-hydroxy-9-oxabicyclo[3.3.1]nonan-2-one
CAS Registry Number 60378-22-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H11DO3
InChI InChI=1S/C8H12O3/c9-5-1-3-7-6(10)2-4-8(5)11-7/h5,7-9H,1-4H2/t5-,7+,8-/m1/s1/i7D
InChIKey GUKXZHWRPPXJQD-PFBFRKNPSA-N
Molecular Weight 157.187 g/mol
SMILES O[C@]1([C@]2(CCC(=O)[C@@](O2)(CC1)[D])[H])[H]
SPLASH splash10-05fr-9200000000-6a8bc368f9df6a2c530b
Source of Spectrum H-59-432-19
Wiley ID 1153510