21-Hydroxy-19-methoxy-arenarone - acetate - Optional[MS (GC)] - Spectrum

SpectraBase Compound ID	4CI9p3ZeqwA
InChI	InChI=1S/C24H32O5/c1-14-8-7-9-20-23(14,4)11-10-15(2)24(20,5)13-17-18(26)12-19(28-6)21(27)22(17)29-16(3)25/h12,15,20H,1,7-11,13H2,2-6H3/t15-,20+,23-,24+/m0/s1
InChIKey	YWZUCOMBCLKTHM-KSVBPBMVSA-N Google Search
Mol Weight	400.5 g/mol
Molecular Formula	C24H32O5
Exact Mass	400.224974 g/mol

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SpectraBase Spectrum ID	MrqmqmlB62
Name	21-Hydroxy-19-methoxy-arenarone - acetate
Alternate Name(s)	1-Hydroxy-5-methoxy-2-[[1',2',10-trimethyl-5'-methylene--napthalen-1'-yl)methyl]-1,4-cyclohexadiene-3,6-dione Acetic acid [2-[[(1R,2S,4aR,8aS)-1,2,4a-trimethyl-5-methylene-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]methyl]-5-methoxy-3,6-dioxo-1-cyclohexa-1,4-dienyl] ester [2-[[(1R,2S,4aR,8aS)-1,2,4a-trimethyl-5-methylidene-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]methyl]-5-methoxy-3,6-dioxocyclohexa-1,4-dien-1-yl] acetate [2-[[(1R,2S,4aR,8aS)-1,2,4a-trimethyl-5-methylene-decalin-1-yl]methyl]-5-methoxy-3,6-dioxo-cyclohexa-1,4-dien-1-yl] acetate [2-[[(1R,2S,4aR,8aS)-1,2,4a-trimethyl-5-methylidene-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]methyl]-5-methoxy-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl] ethanoate
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Formula	C24H32O5
InChI	InChI=1S/C24H32O5/c1-14-8-7-9-20-23(14,4)11-10-15(2)24(20,5)13-17-18(26)12-19(28-6)21(27)22(17)29-16(3)25/h12,15,20H,1,7-11,13H2,2-6H3/t15-,20+,23-,24+/m0/s1
InChIKey	YWZUCOMBCLKTHM-KSVBPBMVSA-N
Molecular Weight	400.515 g/mol
SMILES	C1(=C(C(=O)C=C(C1=O)OC)C[C@]1([C@]2([C@@](C(=C)CCC2)(C)CC[C@@]1(C)[H])[H])C)OC(=O)C
SPLASH	splash10-00kb-6910000000-8a3a6bb56cbf37900022
Source of Spectrum	G4-63-456-14
Wiley ID	1608313