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[(1S,2S,3R,4aS,8aS)-3-acetoxy-1-(acetoxymethyl)-5,5,8a-trimethyl-decalin-2-yl]methyl acetate
SpectraBase Compound ID DmVTuV6QlGl
InChI InChI=1S/C21H34O6/c1-13(22)25-11-16-17(12-26-14(2)23)21(6)9-7-8-20(4,5)19(21)10-18(16)27-15(3)24/h16-19H,7-12H2,1-6H3/t16-,17+,18-,19?,21-/m1/s1
InChIKey HPRGSAMQBXMUAF-BHQBIEBGSA-N
Mol Weight 382.5 g/mol
Molecular Formula C21H34O6
Exact Mass 382.235539 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2TSRn5imlWD
Name [(1S,2S,3R,4aS,8aS)-3-acetoxy-1-(acetoxymethyl)-5,5,8a-trimethyl-decalin-2-yl]methyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34O6
InChI InChI=1S/C21H34O6/c1-13(22)25-11-16-17(12-26-14(2)23)21(6)9-7-8-20(4,5)19(21)10-18(16)27-15(3)24/h16-19H,7-12H2,1-6H3/t16-,17+,18-,19?,21-/m1/s1
InChIKey HPRGSAMQBXMUAF-BHQBIEBGSA-N
Molecular Weight 382.497 g/mol
SMILES [C@]12(C(C[C@]([C@@]([C@@]2(COC(=O)C)[H])(COC(=O)C)[H])(OC(=O)C)[H])C(C)(C)CCC1)C
SPLASH splash10-0pw9-9650000000-d270ec7f4030aa69bd66
Source of Spectrum F-51-1854-15
Synonyms [(1S,2S,3R,4aS,8aS)-3-acetyloxy-1-(acetyloxymethyl)-5,5,8a-trimethyl-1,2,3,4,4a,6,7,8-octahydronaphthalen-2-yl]methyl acetate [(1S,2S,3R,4aS,8aS)-3-acetyloxy-1-(acetyloxymethyl)-5,5,8a-trimethyl-1,2,3,4,4a,6,7,8-octahydronaphthalen-2-yl]methyl ethanoate
Wiley ID 790883