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(5aS,9aR)-3-methoxy-5a,6,7,8,9,9a-hexahydrodibenzo-p-dioxin-2-ol
SpectraBase Compound ID 7jg29bd41Gt
InChI InChI=1S/C13H16O4/c1-15-11-7-13-12(6-8(11)14)16-9-4-2-3-5-10(9)17-13/h6-7,9-10,14H,2-5H2,1H3/t9-,10+/m1/s1
InChIKey XWMOXGLZRRNMGK-ZJUUUORDSA-N
Mol Weight 236.27 g/mol
Molecular Formula C13H16O4
Exact Mass 236.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5lzhusmPLe7
Name (5aS,9aR)-3-methoxy-5a,6,7,8,9,9a-hexahydrodibenzo-p-dioxin-2-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O4
InChI InChI=1S/C13H16O4/c1-15-11-7-13-12(6-8(11)14)16-9-4-2-3-5-10(9)17-13/h6-7,9-10,14H,2-5H2,1H3/t9-,10+/m1/s1
InChIKey XWMOXGLZRRNMGK-ZJUUUORDSA-N
Molecular Weight 236.267 g/mol
SMILES Oc1c(cc2c(O[C@]3([C@@](O2)(CCCC3)[H])[H])c1)OC
SPLASH splash10-001i-9530000000-66b472226ab5b6fea76c
Source of Spectrum CV-2002-2713-6
Wiley ID 1610736