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6-Ethoxy-5a,5,6,6,7,7a-hexahydro-5,9-dioxa-10-thiabenz[a]anthracene(5a.alpha.,7a.alpha.)
SpectraBase Compound ID 7XVlkUPQEaA
InChI InChI=1S/C17H18O3S/c1-2-18-15-10-9-14-17(20-15)19-13-8-7-11-5-3-4-6-12(11)16(13)21-14/h3-8,14-15,17H,2,9-10H2,1H3/t14-,15?,17+/m1/s1
InChIKey MCSDURVXHQNKKT-BZEOVNSFSA-N
Mol Weight 302.39 g/mol
Molecular Formula C17H18O3S
Exact Mass 302.097666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HOoDI20uYcD
Name 6-Ethoxy-5a,5,6,6,7,7a-hexahydro-5,9-dioxa-10-thiabenz[a]anthracene(5a.alpha.,7a.alpha.)
Comments Less than 3 mono-isotopic peaks
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Formula C17H18O3S
InChI InChI=1S/C17H18O3S/c1-2-18-15-10-9-14-17(20-15)19-13-8-7-11-5-3-4-6-12(11)16(13)21-14/h3-8,14-15,17H,2,9-10H2,1H3/t14-,15?,17+/m1/s1
InChIKey MCSDURVXHQNKKT-BZEOVNSFSA-N
Molecular Weight 302.388 g/mol
SMILES c12S[C@]3([C@@](Oc2ccc2c1cccc2)(OC(CC3)OCC)[H])[H]
SPLASH splash10-0udi-0019000000-4e0828f27de860ad7eeb
Source of Spectrum J-62-2614-12
Synonyms (4aR)-6-ethoxy-4a,5,6,11-tetrahydro-4H-3,7-dioxa-2-thiatetraphene 9-Ethoxy-9,10,11,11a-tetrahydro-7aH-7,8-dioxa-12-thia-benzo[a]anthracene(5a.alpha.,7a.alpha.)
Wiley ID 1304630