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METHYL-(+)-(2E,6E,10-XI)-10,11-DIHYDROXY-3,7,11-TRIMETHYL-DODECA-2,6-DIENOATE
SpectraBase Compound ID 39SfH6SVP1z
InChI InChI=1S/C16H28O4/c1-12(9-10-14(17)16(3,4)19)7-6-8-13(2)11-15(18)20-5/h7,11,14,17,19H,6,8-10H2,1-5H3/b12-7+,13-11+
InChIKey MBJDYYPZJXVUHJ-ZPLWXOMKSA-N
Mol Weight 284.4 g/mol
Molecular Formula C16H28O4
Exact Mass 284.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID aMRLCk7pSz
Name Methyl farnesoate <10,11-diol->
CAS Registry Number 36999-94-7
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 284.198759378 u
Formula C16H28O4
InChI InChI=1S/C16H28O4/c1-12(9-10-14(17)16(3,4)19)7-6-8-13(2)11-15(18)20-5/h7,11,14,17,19H,6,8-10H2,1-5H3/b12-7+,13-11+
InChIKey MBJDYYPZJXVUHJ-ZPLWXOMKSA-N
Molecular Weight 284.396 g/mol
Number of Peaks 50
RI1 1780
RI2 1457
SMILES OC(C(C)(C)O)CC\C(=C\CC\C(=C\C(OC)=O)C)C
SPLASH splash10-014i-9300000000-7e213ec2dc4bd889878e
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 2,6-Dodecadienoic acid, 10,11-dihydroxy-3,7,11-trimethyl-, methyl ester, (2E,6E)-
Wiley ID LM_FFNSC3_1742