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Acetyl-feselol

View entire compound with spectra: 1 MS (GC)

Acetyl-feselol
SpectraBase Compound ID A4btH9u1X3o
InChI InChI=1S/C26H32O5/c1-16-6-10-22-25(3,4)23(30-17(2)27)12-13-26(22,5)20(16)15-29-19-9-7-18-8-11-24(28)31-21(18)14-19/h6-9,11,14,20,22-23H,10,12-13,15H2,1-5H3/t20-,22-,23-,26+/m1/s1
InChIKey XZODJQWDEJBNRO-DNRBGDKYSA-N
Mol Weight 424.5 g/mol
Molecular Formula C26H32O5
Exact Mass 424.224974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HgAyVTRbYF5
Name Acetyl-feselol
Alternate Name(s) 7-[(2',5',5',8a'-Tetramethyl-6'-acetoxy-naphthalen-1'-yl)methyloxy]-benzopyran-2(2H)-one Acetic acid [(2R,4aR,5R,8aS)-1,1,4a,6-tetramethyl-5-[(2-oxo-1-benzopyran-7-yl)oxymethyl]-2,3,4,5,8,8a-hexahydronaphthalen-2-yl] ester [(2R,4aR,5R,8aS)-1,1,4a,6-tetramethyl-5-[(2-oxochromen-7-yl)oxymethyl]-2,3,4,5,8,8a-hexahydronaphthalen-2-yl] acetate [(2R,4aR,5R,8aS)-1,1,4a,6-tetramethyl-5-[(2-oxidanylidenechromen-7-yl)oxymethyl]-2,3,4,5,8,8a-hexahydronaphthalen-2-yl] ethanoate
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Formula C26H32O5
InChI InChI=1S/C26H32O5/c1-16-6-10-22-25(3,4)23(30-17(2)27)12-13-26(22,5)20(16)15-29-19-9-7-18-8-11-24(28)31-21(18)14-19/h6-9,11,14,20,22-23H,10,12-13,15H2,1-5H3/t20-,22-,23-,26+/m1/s1
InChIKey XZODJQWDEJBNRO-DNRBGDKYSA-N
Molecular Weight 424.537 g/mol
SMILES [C@]12([C@@](C(C)(C)[C@@](CC2)(OC(=O)C)[H])(CC=C([C@]1(COc1cc2OC(=O)C=Cc2cc1)[H])C)[H])C
SPLASH splash10-03ea-0906100000-8adb02829a56f83783d3
Source of Spectrum X2-48-327-2
Wiley ID 1601648