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(1R*,8R*,9R*,12SR*)-1-(Methoxycarbonyl)-9-propyl-14-oxatricyclo[6.4.1.1(9,12)]tetradecan-13-one
SpectraBase Compound ID 8U72zytlzSK
InChI InChI=1S/C18H28O4/c1-3-10-17-12-9-14(22-17)18(16(20)21-2)11-7-5-4-6-8-13(17)15(18)19/h13-14H,3-12H2,1-2H3/t13-,14?,17+,18+/m0/s1
InChIKey BHTFZBWJZQIMHP-DFKWNZJOSA-N
Mol Weight 308.42 g/mol
Molecular Formula C18H28O4
Exact Mass 308.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G6l1oA8Mr10
Name (1R*,8R*,9R*,12SR*)-1-(Methoxycarbonyl)-9-propyl-14-oxatricyclo[6.4.1.1(9,12)]tetradecan-13-one
Alternate Name(s) Methyl (1R,8R,9R)-13-oxo-9-propyl-14-oxatricyclo[6.4.1.1(9,12)]tetradecane-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H28O4
InChI InChI=1S/C18H28O4/c1-3-10-17-12-9-14(22-17)18(16(20)21-2)11-7-5-4-6-8-13(17)15(18)19/h13-14H,3-12H2,1-2H3/t13-,14?,17+,18+/m0/s1
InChIKey BHTFZBWJZQIMHP-DFKWNZJOSA-N
Molecular Weight 308.418 g/mol
SMILES [C@]12(C([C@@](CCCCCC2)([H])[C@@]2(OC1CC2)CCC)=O)C(=O)OC
SPLASH splash10-03mo-9071000000-d97aa731130dcaa9351c
Source of Spectrum J-64-4129-15
Wiley ID 1530256