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Phytol acetate
SpectraBase Compound ID Joq44Rmb7fy
InChI InChI=1S/C22H42O2/c1-18(2)10-7-11-19(3)12-8-13-20(4)14-9-15-21(5)16-17-24-22(6)23/h16,18-20H,7-15,17H2,1-6H3/b21-16+
InChIKey JIGCTXHIECXYRJ-LTGZKZEYSA-N
Mol Weight 338.6 g/mol
Molecular Formula C22H42O2
Exact Mass 338.318481 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JojEYFpDrgU
Name Phytol acetate <(E)->
CAS Registry Number 10236-16-5
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 338.318480590 u
Formula C22H42O2
InChI InChI=1S/C22H42O2/c1-18(2)10-7-11-19(3)12-8-13-20(4)14-9-15-21(5)16-17-24-22(6)23/h16,18-20H,7-15,17H2,1-6H3/b21-16+
InChIKey JIGCTXHIECXYRJ-LTGZKZEYSA-N
Molecular Weight 338.576 g/mol
Number of Peaks 50
RI1 2221
SMILES C(C)(CCCC(CCCC(CCC\C(=C\COC(C)=O)C)C)C)C
SPLASH splash10-05mo-9100000000-d2bf06bce13ae53d642f
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 2-Hexadecen-1-ol, 3,7,11,15-tetramethyl-, 1-acetate
Wiley ID LM_FFNSC3_2094