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(5R,6R)-6-[(3aR,5S,6aS)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-5-yl]-5,6-dimethyl-1-cyclohex-2-enone
SpectraBase Compound ID ETXxPcjaVqx
InChI InChI=1S/C14H20O3/c1-9-4-3-5-11(15)14(9,2)12-8-10-6-7-16-13(10)17-12/h3,5,9-10,12-13H,4,6-8H2,1-2H3/t9-,10-,12+,13+,14+/m1/s1
InChIKey GAHHNHKRXONFFA-JHYOHUSXSA-N
Mol Weight 236.31 g/mol
Molecular Formula C14H20O3
Exact Mass 236.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9QkAdWmkYnD
Name (5R,6R)-6-[(3aR,5S,6aS)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-5-yl]-5,6-dimethyl-1-cyclohex-2-enone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O3
InChI InChI=1S/C14H20O3/c1-9-4-3-5-11(15)14(9,2)12-8-10-6-7-16-13(10)17-12/h3,5,9-10,12-13H,4,6-8H2,1-2H3/t9-,10-,12+,13+,14+/m1/s1
InChIKey GAHHNHKRXONFFA-JHYOHUSXSA-N
Molecular Weight 236.311 g/mol
SMILES [C@]1([C@]2(O[C@@]3(OCC[C@@]3(C2)[H])[H])[H])(C(C=CC[C@]1(C)[H])=O)C
SPLASH splash10-0229-0900000000-27f5aabe2aea7645d276
Source of Spectrum J-64-9184-15
Synonyms (5R,6R)-6-[(3aR,5S,6aS)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-5-yl]-5,6-dimethyl-cyclohex-2-en-1-one
Wiley ID 1531719