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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 3r4iwmnVSkY
Name Manoyl oxide <13-epi->
CAS Registry Number 1227-93-6
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 290.260965714 u
Formula C20H34O
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
Number of Peaks 50
RI1 2022
RI2 1698
SMILES C1CC([C@]2([C@](C1)([C@@]1([C@@](CC2)(O[C@@](CC1)(C=C)C)C)[H])C)[H])(C)C
SPLASH splash10-05mo-9520000000-1488c324175786a10568
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 1H-Naphtho[2,1-b]pyran, 3-ethenyldodecahydro-3,4a,7,7,10a-pentamethyl-, (3S,4aR,6aS,10aS,10bR)-
Wiley ID LM_FFNSC3_1745