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[1-Benzyl-2-(4,5-dihydroxy-10-oxo-9,10-dihydro-anthracen-9-yl)-2-oxo-ethyl]-carbamic acid tert-butyl ester
SpectraBase Compound ID BgETINUXVRn
InChI InChI=1S/C28H27NO6/c1-28(2,3)35-27(34)29-19(15-16-9-5-4-6-10-16)25(32)22-17-11-7-13-20(30)23(17)26(33)24-18(22)12-8-14-21(24)31/h4-14,19,22,30-31H,15H2,1-3H3,(H,29,34)
InChIKey RIZLHBSCEBZWPV-UHFFFAOYSA-N
Mol Weight 473.53 g/mol
Molecular Formula C28H27NO6
Exact Mass 473.183838 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6AxdUKeCXjE
Name [1-Benzyl-2-(4,5-dihydroxy-10-oxo-9,10-dihydro-anthracen-9-yl)-2-oxo-ethyl]-carbamic acid tert-butyl ester
Alternate Name(s) 1,8-Dihydroxy-10-{2'-[(1'',1''-dimethylethoxy)]carbonylamino}-1-oxo-3-phenylpropyl-9(10H)-anthracenone tert-butyl 1-benzyl-2-(4,5-dihydroxy-10-oxo-9,10-dihydro-9-anthracenyl)-2-oxoethylcarbamate
Comments Less than 3 mono-isotopic peaks
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Formula C28H27NO6
InChI InChI=1S/C28H27NO6/c1-28(2,3)35-27(34)29-19(15-16-9-5-4-6-10-16)25(32)22-17-11-7-13-20(30)23(17)26(33)24-18(22)12-8-14-21(24)31/h4-14,19,22,30-31H,15H2,1-3H3,(H,29,34)
InChIKey RIZLHBSCEBZWPV-UHFFFAOYSA-N
Molecular Weight 473.525 g/mol
SMILES N(C(OC(C)(C)C)=O)C(C(C1c2c(C(c3c(cccc13)O)=O)c(ccc2)O)=O)Cc1ccccc1
SPLASH splash10-004i-0090000000-ac4f0f173c224c4da0f1
Source of Spectrum D8-332-34-2
Wiley ID 1516662