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Helvetolide
SpectraBase Compound ID 94qx8HpoMeu
InChI InChI=1S/C17H32O3/c1-7-15(18)19-12-17(5,6)20-13(2)14-9-8-10-16(3,4)11-14/h13-14H,7-12H2,1-6H3
InChIKey LSTSBZKIQFOPHA-UHFFFAOYSA-N
Mol Weight 284.4 g/mol
Molecular Formula C17H32O3
Exact Mass 284.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EftoNpYvmU
Name Helvetolide
CAS Registry Number 141773-73-1
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 284.235144887 u
Formula C17H32O3
InChI InChI=1S/C17H32O3/c1-7-15(18)19-12-17(5,6)20-13(2)14-9-8-10-16(3,4)11-14/h13-14H,7-12H2,1-6H3
InChIKey LSTSBZKIQFOPHA-UHFFFAOYSA-N
Molecular Weight 284.440 g/mol
Number of Peaks 50
RI1 1707
RI2 1383
RI3 1381
RI4 1342
RI5 1705
SMILES C1C(CC(CC1)C(C)OC(COC(=O)CC)(C)C)(C)C
SPLASH splash10-0a6r-9300000000-ed60654f59d4635bf869
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-Propanol, 2-[1-(3,3-dimethylcyclohexyl)ethoxy]-2-methyl-, 1-propanoate
Wiley ID LM_FFNSC3_1825