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Ferruginol acetate <trans->
SpectraBase Compound ID ImkShKj6V9q
InChI InChI=1S/C22H32O2/c1-14(2)17-12-16-8-9-20-21(4,5)10-7-11-22(20,6)18(16)13-19(17)24-15(3)23/h12-14,20H,7-11H2,1-6H3
InChIKey AZEPENWNEVUZPW-UHFFFAOYSA-N
Mol Weight 328.5 g/mol
Molecular Formula C22H32O2
Exact Mass 328.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dh4VWggrvo2
Name Ferruginol acetate
CAS Registry Number 15340-79-1
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 328.240230268 u
Formula C22H32O2
InChI InChI=1S/C22H32O2/c1-14(2)17-12-16-8-9-20-21(4,5)10-7-11-22(20,6)18(16)13-19(17)24-15(3)23/h12-14,20H,7-11H2,1-6H3
InChIKey AZEPENWNEVUZPW-UHFFFAOYSA-N
Molecular Weight 328.496 g/mol
Number of Peaks 50
RI1 2366
SMILES CC(C)c1cc2CCC3C(C)(C)CCCC3(C)c2cc1OC(C)=O
SPLASH splash10-000l-6970000000-21f78c98bdfb958219c1
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 3-Phenanthrenol-, 4b,5,6,7,8,8a,9,10-octahydro-4b,8,8-trimethyl-2-(1-methylethyl)-
Wiley ID LM_FFNSC3_2269