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2(1H)-Naphthalenone, 1-[2-(acetyloxy)-1-methylethyl]-3,4,6,7,8,8a-hexahydro-8,8a-dimethyl- , [1R-[1.alpha.(S*),8.beta.,8a.beta.]]-
SpectraBase Compound ID DGKM86qqEe5
InChI InChI=1S/C17H26O3/c1-11(10-20-13(3)18)16-15(19)9-8-14-7-5-6-12(2)17(14,16)4/h7,11-12,16H,5-6,8-10H2,1-4H3/t11?,12-,16-,17+/m0/s1
InChIKey LSIBEDRSTFWRIE-JHXUIPSISA-N
Mol Weight 278.39 g/mol
Molecular Formula C17H26O3
Exact Mass 278.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hyh3G2JRGUt
Name 2(1H)-Naphthalenone, 1-[2-(acetyloxy)-1-methylethyl]-3,4,6,7,8,8a-hexahydro-8,8a-dimethyl- , [1R-[1.alpha.(S*),8.beta.,8a.beta.]]-
CAS Registry Number 72646-58-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H26O3
InChI InChI=1S/C17H26O3/c1-11(10-20-13(3)18)16-15(19)9-8-14-7-5-6-12(2)17(14,16)4/h7,11-12,16H,5-6,8-10H2,1-4H3/t11?,12-,16-,17+/m0/s1
InChIKey LSIBEDRSTFWRIE-JHXUIPSISA-N
Molecular Weight 278.392 g/mol
SMILES [C@]12([C@](C(=O)CCC2=CCC[C@@]1(C)[H])(C(COC(=O)C)C)[H])C
SPLASH splash10-004i-0590000000-649703dfec48c6a78bd3
Source of Spectrum AN-88-322-0
Synonyms 2-[(1R,8S,8aS)-8,8a-dimethyl-2-oxo-1,2,3,4,6,7,8,8a-octahydro-1-naphthalenyl]propyl acetate 7-keto, monoacetate, 7,12-dihydro derivative of lemnalactone
Wiley ID 1282279