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Furan adduct of bicyclo[3.3.1]non-2-one 70:30 endo:exo
SpectraBase Compound ID 5Xf4m7qRFmU
InChI InChI=1S/C13H16O2/c14-9-6-8-2-1-5-13(7-8)11-4-3-10(15-11)12(9)13/h3-4,8,10-12H,1-2,5-7H2/t8-,10-,11+,12+,13+/m0/s1
InChIKey LBKJNIARPXRXQG-BQSNPHCVSA-N
Mol Weight 204.27 g/mol
Molecular Formula C13H16O2
Exact Mass 204.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7JX48EANcDS
Name Furan adduct of bicyclo[3.3.1]non-2-one 70:30 endo:exo
Alternate Name(s) (1.alpha.,4.alpha.,4a.alpha.,8.alpha.,10a.beta.)-1,6,7,8,9,10a-Hexahydro-4H-1,4-epoxy-4a,8-methanobenzocycloocten-10(5H)-one (1S,2R,5S,6S,9R)-14-oxatetracyclo[7.3.1.1(2,5).0(1,6)]tetradec-3-en-7-one
CAS Registry Number 71423-34-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O2
InChI InChI=1S/C13H16O2/c14-9-6-8-2-1-5-13(7-8)11-4-3-10(15-11)12(9)13/h3-4,8,10-12H,1-2,5-7H2/t8-,10-,11+,12+,13+/m0/s1
InChIKey LBKJNIARPXRXQG-BQSNPHCVSA-N
Molecular Weight 204.269 g/mol
SMILES [C@@]123[C@@]([C@@]4([H])O[C@@]3(C=C4)[H])(C(=O)C[C@](C2)([H])CCC1)[H]
SPLASH splash10-053f-9400000000-c9183ad07c29ce57e990
Source of Spectrum GT-1986-96-0
Wiley ID 1202042