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1,5-Naphthalenediol, decahydro-1-methyl-4-(1-methylethyl)-, 5-acetate, (1.alpha.,4.beta.,4a.beta.,5.beta.,8a.beta.)-(.+-.)-
SpectraBase Compound ID 5vXDbFDqU0L
InChI InChI=1S/C16H28O3/c1-10(2)12-8-9-16(4,18)13-6-5-7-14(15(12)13)19-11(3)17/h10,12-15,18H,5-9H2,1-4H3/t12-,13-,14-,15-,16+/m0/s1
InChIKey YSQIEHAJFZSGMJ-UVPYHEFZSA-N
Mol Weight 268.4 g/mol
Molecular Formula C16H28O3
Exact Mass 268.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2kTyqSaa4Gw
Name 1,5-Naphthalenediol, decahydro-1-methyl-4-(1-methylethyl)-, 5-acetate, (1.alpha.,4.beta.,4a.beta.,5.beta.,8a.beta.)-(.+-.)-
CAS Registry Number 94853-15-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H28O3
InChI InChI=1S/C16H28O3/c1-10(2)12-8-9-16(4,18)13-6-5-7-14(15(12)13)19-11(3)17/h10,12-15,18H,5-9H2,1-4H3/t12-,13-,14-,15-,16+/m0/s1
InChIKey YSQIEHAJFZSGMJ-UVPYHEFZSA-N
Molecular Weight 268.397 g/mol
SMILES O[C@]1([C@@]2([C@@]([C@@](OC(=O)C)(CCC2)[H])([C@@](CC1)(C(C)C)[H])[H])[H])C
SPLASH splash10-0006-4910000000-b796b3708713d17a213d
Source of Spectrum F-40-3496-0
Synonyms (1S,4aS,5R,8S,8aS)-5-hydroxy-8-isopropyl-5-methyldecahydro-1-naphthalenyl acetate rac-(1R,2S,5R,6R,7R)-2-hydroxy-5-isopropyl-2-methyl-bicyclo[4.4.0]dec-7-yl-acetate
Wiley ID 1272399