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Naphtho[1,2-d]-1,3-dioxepin-11(4H)-one, decahydro-8-hydroxy-2,2,5,7a-tetramethyl-, (5.alpha.,5a.alpha.,7a.beta.,8.beta.,11a.alpha.,11b.beta.)-(.+-.)-
SpectraBase Compound ID Akq6gtf0DNv
InChI InChI=1S/C17H28O4/c1-10-9-20-16(2,3)21-15-11(10)7-8-17(4)13(19)6-5-12(18)14(15)17/h10-11,13-15,19H,5-9H2,1-4H3/t10-,11+,13-,14-,15+,17+/m0/s1
InChIKey LKIZCMRPAKLBAC-PECUKZMNSA-N
Mol Weight 296.41 g/mol
Molecular Formula C17H28O4
Exact Mass 296.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7FrlRj6YaNJ
Name Naphtho[1,2-d]-1,3-dioxepin-11(4H)-one, decahydro-8-hydroxy-2,2,5,7a-tetramethyl-, (5.alpha.,5a.alpha.,7a.beta.,8.beta.,11a.alpha.,11b.beta.)-(.+-.)-
CAS Registry Number 95682-53-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H28O4
InChI InChI=1S/C17H28O4/c1-10-9-20-16(2,3)21-15-11(10)7-8-17(4)13(19)6-5-12(18)14(15)17/h10-11,13-15,19H,5-9H2,1-4H3/t10-,11+,13-,14-,15+,17+/m0/s1
InChIKey LKIZCMRPAKLBAC-PECUKZMNSA-N
Molecular Weight 296.407 g/mol
SMILES O[C@@]1([C@@]2([C@]([C@@]3(OC(OC[C@@]([C@@]3([H])CC2)(C)[H])(C)C)[H])(C(CC1)=O)[H])C)[H]
SPLASH splash10-0006-9020000000-8710ecaa548b4b4883ab
Source of Spectrum F-40-4379-0
Synonyms (5R,5aR,7aS,8S,11aR,11bR)-8-hydroxy-2,2,5,7a-tetramethyldecahydronaphtho[1,2-d][1,3]dioxepin-11(4H)-one Acetonide derivative of 2S-(1,2,3,4,4a,5,6,7,8,8a.alpha.-decahydro-5.beta.-hydroxy-4a.beta.-methyl-1.alpha.-trimethylsilyloxy-8-oxonaphthalene-2.beta.-yl)propanol
Wiley ID 1299182