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(1S,2R,3R,4S) 5-Phenylcyclohex-5-ene-1,2,3,4-Tetrol-Tetraacetate
SpectraBase Compound ID 9yAkfiv724b
InChI InChI=1S/C20H22O8/c1-11(21)25-17-10-16(15-8-6-5-7-9-15)18(26-12(2)22)20(28-14(4)24)19(17)27-13(3)23/h5-10,17-20H,1-4H3/t17-,18-,19+,20+/m0/s1
InChIKey YCLYGKQQZBXMBI-VNTMZGSJSA-N
Mol Weight 390.39 g/mol
Molecular Formula C20H22O8
Exact Mass 390.131468 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4BXfVreE8hQ
Name (1S,2R,3R,4S) 5-Phenylcyclohex-5-ene-1,2,3,4-Tetrol-Tetraacetate
Alternate Name(s) (1R,2S,5S,6R)-2,5,6-tris(acetyloxy)-3-phenyl-3-cyclohexen-1-yl acetate 5-Phenylcyclohex-5-ene-1,2,3,4-Tetrol-Tetraacetate
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Formula C20H22O8
InChI InChI=1S/C20H22O8/c1-11(21)25-17-10-16(15-8-6-5-7-9-15)18(26-12(2)22)20(28-14(4)24)19(17)27-13(3)23/h5-10,17-20H,1-4H3/t17-,18-,19+,20+/m0/s1
InChIKey YCLYGKQQZBXMBI-VNTMZGSJSA-N
Molecular Weight 390.388 g/mol
SMILES [C@@]1([C@](C(c2ccccc2)=C[C@@]([C@]1(OC(=O)C)[H])(OC(=O)C)[H])(OC(=O)C)[H])(OC(=O)C)[H]
SPLASH splash10-000i-0930000000-a1799ef8a9047c7170d4
Source of Spectrum H-90-2233-13
Wiley ID 1590898