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Methyl 10-acetyl-2-ethyl-8-methoxy-6-methyl-3,4,5,6-tetrahydro-2,6-methano-2H-1-benzoxocin-11-ethanoate
SpectraBase Compound ID AW0ThXgOaRn
InChI InChI=1S/C21H28O5/c1-6-21-9-7-8-20(3,17(21)12-18(23)25-5)16-11-14(24-4)10-15(13(2)22)19(16)26-21/h10-11,17H,6-9,12H2,1-5H3/t17-,20-,21-/m0/s1
InChIKey XTGQJKBOZQTXKV-YYWHXJBOSA-N
Mol Weight 360.45 g/mol
Molecular Formula C21H28O5
Exact Mass 360.193674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3PEbdeNa4Dv
Name Methyl 10-acetyl-2-ethyl-8-methoxy-6-methyl-3,4,5,6-tetrahydro-2,6-methano-2H-1-benzoxocin-11-ethanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28O5
InChI InChI=1S/C21H28O5/c1-6-21-9-7-8-20(3,17(21)12-18(23)25-5)16-11-14(24-4)10-15(13(2)22)19(16)26-21/h10-11,17H,6-9,12H2,1-5H3/t17-,20-,21-/m0/s1
InChIKey XTGQJKBOZQTXKV-YYWHXJBOSA-N
Molecular Weight 360.450 g/mol
SMILES c12c([C@@]3(CCC[C@](O2)([C@]3(CC(=O)OC)[H])CC)C)cc(cc1C(=O)C)OC
SPLASH splash10-0btc-4196000000-4551bf00f5f5e50a746e
Source of Spectrum B-51-1172-25
Synonyms Methyl (6-acetyl-9-ethyl-4-methoxy-1-methyl-8-oxatricyclo[7.3.1.0(2,7)]trideca-2,4,6-trien-13-yl)acetate
Wiley ID 746030