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(2R,3R,4R,6S,8S,10S)-10-benzyloxy-8-benzyloxymethyl-2-isopropyl-3-methyl-1,7-dioxaspiro[5.5]undecan-4-ol
SpectraBase Compound ID IxO0PxtKQaK
InChI InChI=1S/C28H38O5/c1-20(2)27-21(3)26(29)16-28(33-27)15-24(31-18-23-12-8-5-9-13-23)14-25(32-28)19-30-17-22-10-6-4-7-11-22/h4-13,20-21,24-27,29H,14-19H2,1-3H3/t21-,24+,25+,26-,27-,28+/m1/s1
InChIKey PGRQSXAFEVBVNF-FVHFCLPPSA-N
Mol Weight 454.6 g/mol
Molecular Formula C28H38O5
Exact Mass 454.271924 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GqmfwuTWVqZ
Name (2R,3R,4R,6S,8S,10S)-10-benzyloxy-8-benzyloxymethyl-2-isopropyl-3-methyl-1,7-dioxaspiro[5.5]undecan-4-ol
Alternate Name(s) (2R,3R,4R,6S,8S,10S)-10-(benzyloxy)-8-[(benzyloxy)methyl]-3-methyl-2-(propan-2-yl)-1,7-dioxaspiro[5.5]undecan-4-ol
CAS Registry Number 97848-46-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H38O5
InChI InChI=1S/C28H38O5/c1-20(2)27-21(3)26(29)16-28(33-27)15-24(31-18-23-12-8-5-9-13-23)14-25(32-28)19-30-17-22-10-6-4-7-11-22/h4-13,20-21,24-27,29H,14-19H2,1-3H3/t21-,24+,25+,26-,27-,28+/m1/s1
InChIKey PGRQSXAFEVBVNF-FVHFCLPPSA-N
Molecular Weight 454.607 g/mol
SMILES O[C@]1([C@@](C)([C@](O[C@@]2(C1)O[C@](COCc1ccccc1)(C[C@@](C2)(OCc1ccccc1)[H])[H])(C(C)C)[H])[H])[H]
SPLASH splash10-0006-9200000000-529245d2ac6dd4b4d6bb
Source of Spectrum KC-1988-94-36
Wiley ID 1388853