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(Z)-(+/-)-(2R,4aS,12aS)-2-(4-Methoxyphenyl)-4a,7,8,9,12,12a-hexahydrooxecino[10,9-e]-1,3-dioxin-6-one
SpectraBase Compound ID Ew2izMTDvKA
InChI InChI=1S/C18H22O5/c1-20-14-10-8-13(9-11-14)18-21-12-16-15(23-18)6-4-2-3-5-7-17(19)22-16/h2,4,8-11,15-16,18H,3,5-7,12H2,1H3/b4-2-/t15-,16-,18+/m0/s1
InChIKey AIVKVLULFBUTAX-WUTSBDBDSA-N
Mol Weight 318.37 g/mol
Molecular Formula C18H22O5
Exact Mass 318.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dm1Y0xdyI6O
Name (Z)-(+/-)-(2R,4aS,12aS)-2-(4-Methoxyphenyl)-4a,7,8,9,12,12a-hexahydrooxecino[10,9-e]-1,3-dioxin-6-one
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Formula C18H22O5
InChI InChI=1S/C18H22O5/c1-20-14-10-8-13(9-11-14)18-21-12-16-15(23-18)6-4-2-3-5-7-17(19)22-16/h2,4,8-11,15-16,18H,3,5-7,12H2,1H3/b4-2-/t15-,16-,18+/m0/s1
InChIKey AIVKVLULFBUTAX-WUTSBDBDSA-N
Literature Reference DOI 10.1002_1615-4169(200208)344_6-7_657
Molecular Weight 318.369 g/mol
SMILES C1\C=C/C[C@]2([C@@](OC(CC1)=O)(CO[C@](O2)(c1ccc(cc1)OC)[H])[H])[H]
SPLASH splash10-004i-3902000000-fec8ddcb3dd1d2468fce
Source of Spectrum ASC-344-662-(Z)_22
Synonyms (2R,4aS,12aS,Z)-2-(4-methoxyphenyl)-4,4a,8,9,12,12a-hexahydro-[1,3]dioxino[5,4-b]oxecin-6(7H)-one
Wiley ID 1767285