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2,6..alpha.-Dimethyl-10..alpha.-acetoxy-9-(1,2.alpha.-dihydroxy-2-.beta.-methylethyl)bicyclo[4.4.0]dec-1-en-3-one

View entire compound with spectra: 1 MS (GC)

2,6..alpha.-Dimethyl-10..alpha.-acetoxy-9-(1,2.alpha.-dihydroxy-2-.beta.-methylethyl)bicyclo[4.4.0]dec-1-en-3-one
SpectraBase Compound ID 7SS7eoXhKJT
InChI InChI=1S/C17H26O5/c1-10-13(20)6-8-16(3)7-5-12(17(4,21)9-18)15(14(10)16)22-11(2)19/h12,15,18,21H,5-9H2,1-4H3/t12-,15+,16-,17-/m1/s1
InChIKey GXINTQJQDVYUCV-VJUNAUMWSA-N
Mol Weight 310.39 g/mol
Molecular Formula C17H26O5
Exact Mass 310.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5s95PemoHTX
Name 2,6..alpha.-Dimethyl-10..alpha.-acetoxy-9-(1,2.alpha.-dihydroxy-2-.beta.-methylethyl)bicyclo[4.4.0]dec-1-en-3-one
Alternate Name(s) (1S,2R,4aR)-2-[(1S)-1,2-dihydroxy-1-methylethyl]-4a,8-dimethyl-7-oxo-1,2,3,4,4a,5,6,7-octahydro-1-naphthalenyl acetate 2,6-Dimethyl-10-acetoxy-9-(1,2.alpha.-dihydroxy-2-.beta.-methylethyl)bicyclo[4.4.0]dec-1-en-3-one Acetic acid[(1S,2R,4aR)-2-[(1S)-1,2-dihydroxy-1-methyl-ethyl]-7-keto-4a,8-dimethyl-1,2,3,4,5,6-hexahydronaphthalen-1-yl]ester Acetic acid[(1S,2R,4aR)-2-[(2S)-1,2-dihydroxypropan-2-yl]-4a,8-dimethyl-7-oxo-1,2,3,4,5,6-hexahydronaphthalen-1-yl]ester [(1S,2R,4aR)-2-[(1S)-1,2-dihydroxy-1-methyl-ethyl]-4a,8-dimethyl-7-oxo-1,2,3,4,5,6-hexahydronaphthalen-1-yl]acetate [(1S,2R,4aR)-2-[(2S)-1,2-bis(oxidanyl)propan-2-yl]-4a,8-dimethyl-7-oxidanylidene-1,2,3,4,5,6-hexahydronaphthalen-1-yl]ethanoate [(1S,2R,4aR)-2-[(2S)-1,2-dihydroxypropan-2-yl]-4a,8-dimethyl-7-oxo-1,2,3,4,5,6-hexahydronaphthalen-1-yl]acetate Acetic acid [(1S,2R,4aR)-2-[(2S)-1,2-dihydroxypropan-2-yl]-4a,8-dimethyl-7-oxo-1,2,3,4,5,6-hexahydronaphthalen-1-yl] ester [(1S,2R,4aR)-2-[(2S)-1,2-dihydroxypropan-2-yl]-4a,8-dimethyl-7-oxo-1,2,3,4,5,6-hexahydronaphthalen-1-yl] acetate [(1S,2R,4aR)-2-[(1S)-1,2-dihydroxy-1-methyl-ethyl]-4a,8-dimethyl-7-oxo-1,2,3,4,5,6-hexahydronaphthalen-1-yl] acetate [(1S,2R,4aR)-2-[(2S)-1,2-bis(oxidanyl)propan-2-yl]-4a,8-dimethyl-7-oxidanylidene-1,2,3,4,5,6-hexahydronaphthalen-1-yl] ethanoate
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Formula C17H26O5
InChI InChI=1S/C17H26O5/c1-10-13(20)6-8-16(3)7-5-12(17(4,21)9-18)15(14(10)16)22-11(2)19/h12,15,18,21H,5-9H2,1-4H3/t12-,15+,16-,17-/m1/s1
InChIKey GXINTQJQDVYUCV-VJUNAUMWSA-N
Molecular Weight 310.390 g/mol
SMILES O[C@](CO)([C@]1([C@@](C2=C(C(=O)CC[C@]2(CC1)C)C)(OC(=O)C)[H])[H])C
SPLASH splash10-004i-2910000000-3446c31bc98b7087b3aa
Source of Spectrum KC-57-2175-5
Wiley ID 1623397