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(+)-exo-4,5-(Isopropylidenediocy)-endo-tricyclo[5.2.1.0(2,6)]dec-8-en-3-one
SpectraBase Compound ID KzPJAl0XQxn
InChI InChI=1S/C13H16O3/c1-13(2)15-11-9-7-4-3-6(5-7)8(9)10(14)12(11)16-13/h3-4,6-9,11-12H,5H2,1-2H3/t6-,7+,8-,9+,11-,12+/m0/s1
InChIKey IRKXBALTLQLSOX-KSNKSXCASA-N
Mol Weight 220.27 g/mol
Molecular Formula C13H16O3
Exact Mass 220.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 85n94eSTwB2
Name (+)-exo-4,5-(Isopropylidenediocy)-endo-tricyclo[5.2.1.0(2,6)]dec-8-en-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O3
InChI InChI=1S/C13H16O3/c1-13(2)15-11-9-7-4-3-6(5-7)8(9)10(14)12(11)16-13/h3-4,6-9,11-12H,5H2,1-2H3/t6-,7+,8-,9+,11-,12+/m0/s1
InChIKey IRKXBALTLQLSOX-KSNKSXCASA-N
Molecular Weight 220.268 g/mol
SMILES [C@@]12(C([C@]3([C@]4(C=C[C@@]([C@]3([C@@]2(OC(O1)(C)C)[H])[H])(C4)[H])[H])[H])=O)[H]
SPLASH splash10-014i-9120000000-681b38149c4c3f927624
Source of Spectrum F-50-8534-17
Synonyms 5,5-Dimethyl-4,6-dioxatetracyclo[8.2.1.0(2,9).0(3,7)]tridec-11-en-8-one
Wiley ID 1219986