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4a,9a-Epoxy-1,4-methanoanthracene, 1,2,3,4,9,10-hexahydro-5,8-dimethoxy-, (1.alpha.,4.alpha.,4a.alpha.,9a.alpha.)-
SpectraBase Compound ID 1AQevwTGNRa
InChI InChI=1S/C17H20O3/c1-18-14-5-6-15(19-2)13-9-17-11-4-3-10(7-11)16(17,20-17)8-12(13)14/h5-6,10-11H,3-4,7-9H2,1-2H3/t10-,11+,16+,17-
InChIKey CLYZSNKKCSPCEW-BRTARUFTSA-N
Mol Weight 272.34 g/mol
Molecular Formula C17H20O3
Exact Mass 272.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KiXGOyC8lKd
Name 4a,9a-Epoxy-1,4-methanoanthracene, 1,2,3,4,9,10-hexahydro-5,8-dimethoxy-, (1.alpha.,4.alpha.,4a.alpha.,9a.alpha.)-
Alternate Name(s) (1R,10S,11R,14S)-4,7-dimethoxy-15-oxapentacyclo[8.4.1.1(11,14).0(1,10).0(3,8)]hexadeca-3,5,7-triene 8a,10a-epoxy-5,6,7,8,8a,9,10,10a-octahydro-1,4-dimethoxy-5,8-methanoanthracene
CAS Registry Number 104825-00-5
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20O3
InChI InChI=1S/C17H20O3/c1-18-14-5-6-15(19-2)13-9-17-11-4-3-10(7-11)16(17,20-17)8-12(13)14/h5-6,10-11H,3-4,7-9H2,1-2H3/t10-,11+,16+,17-
InChIKey CLYZSNKKCSPCEW-BRTARUFTSA-N
Molecular Weight 272.344 g/mol
SMILES [C@]123[C@@](Cc4c(C3)c(ccc4OC)OC)([C@]3([H])C[C@]2(CC3)[H])O1
SPLASH splash10-0udi-0090000000-0fa1485ef2ddf8473020
Source of Spectrum H-68-1727-36
Wiley ID 1276445