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(+-)-(1.alpha.,2.alpha.,5.beta.,6.beta.,9.beta.,11.alpha.)-5-hydroxy-6-methyl-12,13-didehydro-14-oxatetracyclo[7.4.1(1,11).0(2,6)]tetradecan-8-one

View entire compound with spectra: 1 MS (GC)

(+-)-(1.alpha.,2.alpha.,5.beta.,6.beta.,9.beta.,11.alpha.)-5-hydroxy-6-methyl-12,13-didehydro-14-oxatetracyclo[7.4.1(1,11).0(2,6)]tetradecan-8-one
SpectraBase Compound ID 6xt2fMnyOzt
InChI InChI=1S/C14H18O3/c1-14-8-9(15)2-3-10-4-6-12(17-10)11(14)5-7-13(14)16/h4-7,10-13,16H,2-3,8H2,1H3/t10-,11+,12-,13+,14-/m0/s1
InChIKey SDKNRQVSKJFTHT-VJTDZRGJSA-N
Mol Weight 234.29 g/mol
Molecular Formula C14H18O3
Exact Mass 234.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Ho56LwXrOs
Name (+-)-(1.alpha.,2.alpha.,5.beta.,6.beta.,9.beta.,11.alpha.)-5-hydroxy-6-methyl-12,13-didehydro-14-oxatetracyclo[7.4.1(1,11).0(2,6)]tetradecan-8-one
Alternate Name(s) (1S,2S,5R,6S,11S)-5-hydroxy-6-methyl-14-oxatricyclo[9.2.1.0(2,6)]tetradeca-3,12-dien-8-one
CAS Registry Number 87530-43-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O3
InChI InChI=1S/C14H18O3/c1-14-8-9(15)2-3-10-4-6-12(17-10)11(14)5-7-13(14)16/h4-7,10-13,16H,2-3,8H2,1H3/t10-,11+,12-,13+,14-/m0/s1
InChIKey SDKNRQVSKJFTHT-VJTDZRGJSA-N
Molecular Weight 234.295 g/mol
SMILES O[C@@]1(C=C[C@]2([C@@]1(CC(=O)CC[C@@]1(O[C@]2(C=C1)[H])[H])C)[H])[H]
SPLASH splash10-06r7-8900000000-d14250f8d531839fbbb4
Source of Spectrum F-41-4676-13
Wiley ID 1236121