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13-epi-Manool oxide
SpectraBase Compound ID C7e30HLM7dW
InChI InChI=1S/C20H34O/c1-7-18(4)13-9-16-19(5)12-8-11-17(2,3)15(19)10-14-20(16,6)21-18/h7,15-16H,1,8-14H2,2-6H3/t15-,16+,18+,19-,20+/m0/s1
InChIKey IGGWKHQYMAJOHK-GRLGQGAKSA-N
Mol Weight 290.5 g/mol
Molecular Formula C20H34O
Exact Mass 290.260966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LrUOrR6jUZi
Name 13-epi-Manool oxide
Alternate Name(s) Manool oxide<13-epi->
CAS Registry Number 1227-93-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H34O
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C20H34O/c1-7-18(4)13-9-16-19(5)12-8-11-17(2,3)15(19)10-14-20(16,6)21-18/h7,15-16H,1,8-14H2,2-6H3/t15-,16+,18+,19-,20+/m0/s1
InChIKey IGGWKHQYMAJOHK-GRLGQGAKSA-N
Molecular Weight 290.491 g/mol
SMILES C[C@@]12[C@@]3([C@](C)(O[C@@](CC3)(C=C)C)CC[C@]1(C(C)(C)CCC2)[H])[H]
SPLASH splash10-054o-9840000000-571eb25d1e7f7bc8a23e
Source ex DRAGOCO ex E. VON RUDLOFF
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1886639