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Manool
SpectraBase Compound ID 86TW61mzc9r
InChI InChI=1S/C20H34O/c1-7-19(5,21)14-11-16-15(2)9-10-17-18(3,4)12-8-13-20(16,17)6/h7,16-17,21H,1-2,8-14H2,3-6H3
InChIKey CECREIRZLPLYDM-UHFFFAOYSA-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 9qilUx8Y0D4
Name Manool
CAS Registry Number 106631-38-3
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/c1-7-19(5,21)14-11-16-15(2)9-10-17-18(3,4)12-8-13-20(16,17)6/h7,16-17,21H,1-2,8-14H2,3-6H3
InChIKey CECREIRZLPLYDM-UHFFFAOYSA-N
Molecular Weight 290.491 g/mol
Number of Peaks 50
RI1 2062
RI2 1737
RI3 2013
RI4 1978
SMILES OC(CCC1C2(C(CCC1=C)C(CCC2)(C)C)C)(C=C)C
SPLASH splash10-0537-9600000000-51bc229b024e23835832
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 1-Naphthalenepropanol, alpha-ethenyldecahydro-alpha,5,5,8a-tetramethyl-2-methylene
Wiley ID LM_FFNSC3_949