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2-Oxabicyclo[3.2.1]octan-3-one, 8-(2-pentenyl)-, [1.alpha.,5.alpha.,8(Z)]-(.+-.)-
SpectraBase Compound ID GfiExKVxevg
InChI InChI=1S/C12H18O2/c1-2-3-4-5-10-9-6-7-11(10)14-12(13)8-9/h3-4,9-11H,2,5-8H2,1H3/b4-3+/t9-,10?,11-/m0/s1
InChIKey FGQKBLLAYNAHJG-QPVKAAMVSA-N
Mol Weight 194.27 g/mol
Molecular Formula C12H18O2
Exact Mass 194.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DgKyPh5Pxu9
Name 2-Oxabicyclo[3.2.1]octan-3-one, 8-(2-pentenyl)-, [1.alpha.,5.alpha.,8(Z)]-(.+-.)-
CAS Registry Number 53403-88-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-2-3-4-5-10-9-6-7-11(10)14-12(13)8-9/h3-4,9-11H,2,5-8H2,1H3/b4-3+/t9-,10?,11-/m0/s1
InChIKey FGQKBLLAYNAHJG-QPVKAAMVSA-N
Molecular Weight 194.274 g/mol
SMILES C1(O[C@@]2(C([C@](C1)(CC2)[H])C\C=C\CC)[H])=O
SPLASH splash10-015c-9300000000-cd1e7351efadcd579ebf
Source of Spectrum J-40-464-0
Synonyms (1S,5S)-8-[(2E)-2-pentenyl]-2-oxabicyclo[3.2.1]octan-3-one 8-syn-(2-cis-pentenyl)-2-oxabicyclo[3.2.1]octan-3-one
Wiley ID 1191044