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1-[(2S)-2-(2-oxanyloxy)propoxy]anthracene-9,10-dione
SpectraBase Compound ID 3BP8ZRS6iDF
InChI InChI=1S/C22H22O5/c1-14(27-19-11-4-5-12-25-19)13-26-18-10-6-9-17-20(18)22(24)16-8-3-2-7-15(16)21(17)23/h2-3,6-10,14,19H,4-5,11-13H2,1H3/t14-,19?/m0/s1
InChIKey LSZVNBUVFLWGOM-KTQQKIMGSA-N
Mol Weight 366.41 g/mol
Molecular Formula C22H22O5
Exact Mass 366.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H1YpqwZPn7u
Name 1-[(2S)-2-(2-oxanyloxy)propoxy]anthracene-9,10-dione
Alternate Name(s) 1-[(2S)-2-(oxan-2-yloxy)propoxy]anthracene-9,10-dione 1-[(2S)-2-tetrahydropyran-2-yloxypropoxy]-9,10-anthraquinone 1-[(2S)-2-tetrahydropyran-2-yloxypropoxy]anthracene-9,10-dione
Comments Less than 3 mono-isotopic peaks
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Formula C22H22O5
InChI InChI=1S/C22H22O5/c1-14(27-19-11-4-5-12-25-19)13-26-18-10-6-9-17-20(18)22(24)16-8-3-2-7-15(16)21(17)23/h2-3,6-10,14,19H,4-5,11-13H2,1H3/t14-,19?/m0/s1
InChIKey LSZVNBUVFLWGOM-KTQQKIMGSA-N
Molecular Weight 366.413 g/mol
SMILES C1(c2c(cccc2OC[C@@](OC2OCCCC2)(C)[H])C(c2c1cccc2)=O)=O
SPLASH splash10-00di-0090000000-47b82b2098ba28692868
Source of Spectrum F-53-4182-2
Wiley ID 801273