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Methyl 11-(3,4-dimethyl-5-pentylfuran-2-yl)undecanoate
SpectraBase Compound ID AdLbS9aYgJM
InChI InChI=1S/C23H40O3/c1-5-6-13-16-21-19(2)20(3)22(26-21)17-14-11-9-7-8-10-12-15-18-23(24)25-4/h5-18H2,1-4H3
InChIKey RFRVAUMNCAWBEI-UHFFFAOYSA-N
Mol Weight 364.6 g/mol
Molecular Formula C23H40O3
Exact Mass 364.297745 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E7HoUrvKZ9B
Name Methyl 11-(3,4-dimethyl-5-pentylfuran-2-yl)undecanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H40O3
GC Column HP-1 (25 m x 0 2 mm)
GC Oven Program Oven temp 300 oC
InChI InChI=1S/C23H40O3/c1-5-6-13-16-21-19(2)20(3)22(26-21)17-14-11-9-7-8-10-12-15-18-23(24)25-4/h5-18H2,1-4H3
InChIKey RFRVAUMNCAWBEI-UHFFFAOYSA-N
Instrument Name Hewlett-Packard 5890-5971
Ionization Type EI
Literature Reference DOI 10.1002/jhrc.1240170505
Molecular Weight 364.570 g/mol
Quality 275
SMILES C=1(OC(=C(C1C)C)CCCCCCCCCCC(OC)=O)CCCCC
SPLASH splash10-07fr-0903000000-3b41aef3c402625b9a67
Source of Spectrum HRC-17-310-Figure 4 (DOI: 10.1002/jhrc.1240170505)
Wiley ID 1910827