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8,8-Bis(carboethoxy)3-oxa-trans-bicyclo[8.1.0]undec-cis-5-en-2-one
SpectraBase Compound ID BQ5zfjnK37P
InChI InChI=1S/C16H22O6/c1-3-20-14(18)16(15(19)21-4-2)7-5-6-8-22-13(17)12-9-11(12)10-16/h5-6,11-12H,3-4,7-10H2,1-2H3/b6-5-/t11-,12+/m0/s1
InChIKey IJOQNMBRDDLZSX-ABZJQCSKSA-N
Mol Weight 310.35 g/mol
Molecular Formula C16H22O6
Exact Mass 310.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I4OVkojABk6
Name 8,8-Bis(carboethoxy)3-oxa-trans-bicyclo[8.1.0]undec-cis-5-en-2-one
Alternate Name(s) Diethyl (1R,10S)-2-oxo-3-oxabicyclo[8.1.0]undec-5-ene-8,8-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O6
InChI InChI=1S/C16H22O6/c1-3-20-14(18)16(15(19)21-4-2)7-5-6-8-22-13(17)12-9-11(12)10-16/h5-6,11-12H,3-4,7-10H2,1-2H3/b6-5-/t11-,12+/m0/s1
InChIKey IJOQNMBRDDLZSX-ABZJQCSKSA-N
Molecular Weight 310.346 g/mol
SMILES C1(C[C@]2([C@@](C(=O)OC\C=C/C1)([H])C2)[H])(C(=O)OCC)C(=O)OCC
SPLASH splash10-0a6u-9700000000-9866eb8b8d0af8f6be25
Source of Spectrum C-119-8832-13
Wiley ID 760560