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(1R,2S,8R,9R)-2-Benzyloxy-8,9-diisopropyl-8,9-dimethyl-3,7,10-trioxabicyclo[4.4.0]decane-5-one

View entire compound with spectra: 1 MS (GC)

(1R,2S,8R,9R)-2-Benzyloxy-8,9-diisopropyl-8,9-dimethyl-3,7,10-trioxabicyclo[4.4.0]decane-5-one
SpectraBase Compound ID I7gBH25mud4
InChI InChI=1S/C22H32O7/c1-14(2)26-21(5)22(6,27-15(3)4)29-19-18(28-21)17(23)13-25-20(19)24-12-16-10-8-7-9-11-16/h7-11,14-15,18-20H,12-13H2,1-6H3/t18?,19-,20+,21-,22-/m1/s1
InChIKey UYGUGYWTUZCICH-RFQIGKHKSA-N
Mol Weight 408.5 g/mol
Molecular Formula C22H32O7
Exact Mass 408.214803 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FLQmTaXz4se
Name (1R,2S,8R,9R)-2-Benzyloxy-8,9-diisopropyl-8,9-dimethyl-3,7,10-trioxabicyclo[4.4.0]decane-5-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32O7
InChI InChI=1S/C22H32O7/c1-14(2)26-21(5)22(6,27-15(3)4)29-19-18(28-21)17(23)13-25-20(19)24-12-16-10-8-7-9-11-16/h7-11,14-15,18-20H,12-13H2,1-6H3/t18?,19-,20+,21-,22-/m1/s1
InChIKey UYGUGYWTUZCICH-RFQIGKHKSA-N
Molecular Weight 408.491 g/mol
SMILES [C@]12(C(O[C@]([C@@](O2)(OC(C)C)C)(OC(C)C)C)C(=O)CO[C@@]1(OCc1ccccc1)[H])[H]
SPLASH splash10-014i-0009100000-cf817c656cdfd2b96219
Source of Spectrum F-70-7288-13
Synonyms (2R,3R,4aR,5S)-5-(benzyloxy)-2,3-dimethyl-2,3-bis(propan-2-yloxy)-hexahydro-2H-pyrano[3,4-b][1,4]dioxin-8-one 2-Benzyloxy-8,9-diisopropyl-8,9-dimethyl-3,7,10-trioxabicyclo[4.4.0]decane-5-one
Wiley ID 1597412