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2H-Cyclohepta[b]furan-2-one, octahydro-8-hydroxy-, (3a.alpha.,8.alpha.,8a.alpha.)-
SpectraBase Compound ID JAYx92OAtuE
InChI InChI=1S/C9H14O3/c10-7-4-2-1-3-6-5-8(11)12-9(6)7/h6-7,9-10H,1-5H2/t6-,7+,9+/m1/s1
InChIKey AKMITMJBGSYBOR-FJXKBIBVSA-N
Mol Weight 170.21 g/mol
Molecular Formula C9H14O3
Exact Mass 170.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LqxaYLJb0TZ
Name 2H-Cyclohepta[b]furan-2-one, octahydro-8-hydroxy-, (3a.alpha.,8.alpha.,8a.alpha.)-
Alternate Name(s) (3a.alpha.,8a.alpha,)-8.alpha.-hydroxyoctahydro-2H-cyclohepta[b]furan-2-one (3aR,8S,8aS)-8-hydroxyoctahydro-2H-cyclohepta[b]furan-2-one
CAS Registry Number 107172-61-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O3
InChI InChI=1S/C9H14O3/c10-7-4-2-1-3-6-5-8(11)12-9(6)7/h6-7,9-10H,1-5H2/t6-,7+,9+/m1/s1
InChIKey AKMITMJBGSYBOR-FJXKBIBVSA-N
Molecular Weight 170.208 g/mol
SMILES O[C@@]1([C@]2(OC(C[C@]2(CCCC1)[H])=O)[H])[H]
SPLASH splash10-001s-9300000000-633b77d91107fc022c50
Source of Spectrum J-52-1435-10
Wiley ID 1166613