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(5aR,9aR)-3-Ethoxy-5a,6,7,8,9,9a-hexahydrodibenzo[1,4]dioxin-2-ol
SpectraBase Compound ID 7oKNZRTUyxw
InChI InChI=1S/C14H18O4/c1-2-16-12-8-14-13(7-9(12)15)17-10-5-3-4-6-11(10)18-14/h7-8,10-11,15H,2-6H2,1H3/t10-,11-/m1/s1
InChIKey LYNMTSAAIVHFRG-GHMZBOCLSA-N
Mol Weight 250.29 g/mol
Molecular Formula C14H18O4
Exact Mass 250.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JOhwErRzmNN
Name (5aR,9aR)-3-Ethoxy-5a,6,7,8,9,9a-hexahydrodibenzo[1,4]dioxin-2-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O4
InChI InChI=1S/C14H18O4/c1-2-16-12-8-14-13(7-9(12)15)17-10-5-3-4-6-11(10)18-14/h7-8,10-11,15H,2-6H2,1H3/t10-,11-/m1/s1
InChIKey LYNMTSAAIVHFRG-GHMZBOCLSA-N
Molecular Weight 250.294 g/mol
SMILES Oc1c(cc2c(O[C@]3([C@](O2)(CCCC3)[H])[H])c1)OCC
SPLASH splash10-001i-9150000000-cbb74209c436cc406d55
Source of Spectrum CV-2002-2714-5
Synonyms (5aR,9aR)-3-ethoxy-5a,6,7,8,9,9a-hexahydrodibenzo[b,e][1,4]dioxin-2-ol trans-3-Ethoxy-5a,6,7,8,9,9a-hexahydrodibenzo[1,4]dioxin-2-ol
Wiley ID 1610734