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Acetic acid (S)-3a-methyl-6-methylene-8,10-dioxo-hexadecahydro-cyclonona[e]inden-3-yl ester
SpectraBase Compound ID 4uTP17OxToK
InChI InChI=1S/C20H28O4/c1-12-10-15(23)11-14(22)4-5-17-16(12)8-9-20(3)18(17)6-7-19(20)24-13(2)21/h16-19H,1,4-11H2,2-3H3/t16?,17?,18?,19?,20-/m0/s1
InChIKey IMIIKZQAYGZEEP-CEVCPLMDSA-N
Mol Weight 332.44 g/mol
Molecular Formula C20H28O4
Exact Mass 332.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ajq2UlHhuAF
Name Acetic acid (S)-3a-methyl-6-methylene-8,10-dioxo-hexadecahydro-cyclonona[e]inden-3-yl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O4
InChI InChI=1S/C20H28O4/c1-12-10-15(23)11-14(22)4-5-17-16(12)8-9-20(3)18(17)6-7-19(20)24-13(2)21/h16-19H,1,4-11H2,2-3H3/t16?,17?,18?,19?,20-/m0/s1
InChIKey IMIIKZQAYGZEEP-CEVCPLMDSA-N
Molecular Weight 332.440 g/mol
SMILES [C@@]12(C(C3CCC(CC(CC(C3CC2)=C)=O)=O)CCC1OC(=O)C)C
SPLASH splash10-0fl3-0098000000-54e3e242c81deac0fe85
Source of Spectrum J-60-8216-13
Wiley ID 1329639