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9-(Ethoxycarbonyl)methyl-4-oxabicyclo[6.3.0]undecan-5-one
SpectraBase Compound ID 80NW236KwsV
InChI InChI=1S/C14H22O4/c1-2-17-14(16)9-11-4-3-10-7-8-18-13(15)6-5-12(10)11/h10-12H,2-9H2,1H3/t10-,11-,12-/m0/s1
InChIKey ITXKQUUBAALUKU-SRVKXCTJSA-N
Mol Weight 254.33 g/mol
Molecular Formula C14H22O4
Exact Mass 254.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID o7TKCvILKb
Name 9-(Ethoxycarbonyl)methyl-4-oxabicyclo[6.3.0]undecan-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O4
InChI InChI=1S/C14H22O4/c1-2-17-14(16)9-11-4-3-10-7-8-18-13(15)6-5-12(10)11/h10-12H,2-9H2,1H3/t10-,11-,12-/m0/s1
InChIKey ITXKQUUBAALUKU-SRVKXCTJSA-N
Molecular Weight 254.326 g/mol
SMILES [C@]1([C@]2(CCC(=O)OCC[C@]2([H])CC1)[H])(CC(=O)OCC)[H]
SPLASH splash10-0aou-9700000000-fefe305c173f75bdaa89
Source of Spectrum C-120-7478-20
Synonyms (1S,8S,9S) 9-(Ethoxycarbonyl)methyl-4-oxa-bicyclo[6.3.0]undecan-5-one Ethyl (4-oxodecahydrocyclopenta[d]oxocin-7-yl)acetate
Wiley ID 760999