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(1R,2S,5S,6S,8R,9R)-5-Benzyloxy-2-hydroxy-8,9-trans-dimethyl-4,7,10-trioxabicyclo[4.4.0]decane

View entire compound with spectra: 1 MS (GC)

(1R,2S,5S,6S,8R,9R)-5-Benzyloxy-2-hydroxy-8,9-trans-dimethyl-4,7,10-trioxabicyclo[4.4.0]decane
SpectraBase Compound ID 7aXBfynaDZU
InChI InChI=1S/C16H22O5/c1-10-11(2)21-15-14(20-10)13(17)9-19-16(15)18-8-12-6-4-3-5-7-12/h3-7,10-11,13-17H,8-9H2,1-2H3/t10-,11-,13+,14+,15-,16+/m1/s1
InChIKey XMTKQIRMTLTGKP-GBDRXRSFSA-N
Mol Weight 294.35 g/mol
Molecular Formula C16H22O5
Exact Mass 294.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FgjTOPgt6Qs
Name (1R,2S,5S,6S,8R,9R)-5-Benzyloxy-2-hydroxy-8,9-trans-dimethyl-4,7,10-trioxabicyclo[4.4.0]decane
Alternate Name(s) (2R,3R,4aR,5S,8S,8aS)-5-(benzyloxy)-2,3-dimethyl-hexahydro-2H-pyrano[3,4-b][1,4]dioxin-8-ol 5-Benzyloxy-2-hydroxy-8,9-trans-dimethyl-4,7,10-trioxabicyclo[4.4.0]decane
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O5
InChI InChI=1S/C16H22O5/c1-10-11(2)21-15-14(20-10)13(17)9-19-16(15)18-8-12-6-4-3-5-7-12/h3-7,10-11,13-17H,8-9H2,1-2H3/t10-,11-,13+,14+,15-,16+/m1/s1
InChIKey XMTKQIRMTLTGKP-GBDRXRSFSA-N
Molecular Weight 294.347 g/mol
SMILES O[C@@]1([C@]2([C@@](O[C@@]([C@@](C)(O2)[H])(C)[H])([C@](OC1)(OCc1ccccc1)[H])[H])[H])[H]
SPLASH splash10-0006-0090000000-c6d9a102be00434faca8
Source of Spectrum F-62-6625-13
Wiley ID 1634053