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1H-Benzo[b]xanthene-3,12(2H,4H)-dione, 4a,12a-dihydro-1-methoxy-, (1.alpha.,4a.alpha.,12a.beta.)-
SpectraBase Compound ID IfmqbaxGs6r
InChI InChI=1S/C18H16O4/c1-21-15-8-12(19)9-16-17(15)18(20)13-6-10-4-2-3-5-11(10)7-14(13)22-16/h2-7,15-17H,8-9H2,1H3/t15-,16-,17-/m0/s1
InChIKey YESDMTAXJGJVFZ-ULQDDVLXSA-N
Mol Weight 296.32 g/mol
Molecular Formula C18H16O4
Exact Mass 296.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HK6q268wgBn
Name 1H-Benzo[b]xanthene-3,12(2H,4H)-dione, 4a,12a-dihydro-1-methoxy-, (1.alpha.,4a.alpha.,12a.beta.)-
CAS Registry Number 113272-18-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16O4
InChI InChI=1S/C18H16O4/c1-21-15-8-12(19)9-16-17(15)18(20)13-6-10-4-2-3-5-11(10)7-14(13)22-16/h2-7,15-17H,8-9H2,1H3/t15-,16-,17-/m0/s1
InChIKey YESDMTAXJGJVFZ-ULQDDVLXSA-N
Molecular Weight 296.322 g/mol
SMILES C1([C@@]2([C@@](CC(C[C@@]2(OC)[H])=O)([H])Oc2c1cc1c(cccc1)c2)[H])=O
SPLASH splash10-01vk-1590000000-d4016fbc86e8d1728d33
Source of Spectrum F-43-3082-27
Synonyms (1.beta.,4a.beta.,12a.alpha.)-1,2,4a,12a-tetrahydro-1-methoxy-4H-benzo[b]xanthene-3,12-dione (1S,4aS,12aS)-1-methoxy-4a,12a-dihydro-1H-benzo[b]xanthene-3,12(2H,4H)-dione
Wiley ID 1299274