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Methyl 14,15-dioxo-isopimaran-18-oate
SpectraBase Compound ID ELx5zlGrOWD
InChI InChI=1S/C21H32O4/c1-13(22)19(2)12-9-15-14(17(19)23)7-8-16-20(15,3)10-6-11-21(16,4)18(24)25-5/h14-16H,6-12H2,1-5H3/t14?,15?,16?,19-,20-,21-/m1/s1
InChIKey YYXBRUBTTGYGBV-BISNMVCHSA-N
Mol Weight 348.5 g/mol
Molecular Formula C21H32O4
Exact Mass 348.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hy1pjzpU2JH
Name Methyl 14,15-dioxo-isopimaran-18-oate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32O4
InChI InChI=1S/C21H32O4/c1-13(22)19(2)12-9-15-14(17(19)23)7-8-16-20(15,3)10-6-11-21(16,4)18(24)25-5/h14-16H,6-12H2,1-5H3/t14?,15?,16?,19-,20-,21-/m1/s1
InChIKey YYXBRUBTTGYGBV-BISNMVCHSA-N
Molecular Weight 348.483 g/mol
SMILES [C@@]1(C(C2CCC3[C@@](C2CC1)(CCC[C@]3(C(=O)OC)C)C)=O)(C(=O)C)C
SPLASH splash10-0a4l-9206000000-8d1f080eab01ce3c3009
Source of Spectrum Y4-87-272-6
Wiley ID 1550261