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Methyl 2,4-diacetoxy-6-[10'-(acetoxy)-8'-pentadecenyl]-benzoate
SpectraBase Compound ID G7OHsLOM4nO
InChI InChI=1S/C29H42O8/c1-6-7-13-17-25(35-21(2)30)18-15-12-10-8-9-11-14-16-24-19-26(36-22(3)31)20-27(37-23(4)32)28(24)29(33)34-5/h15,18-20,25H,6-14,16-17H2,1-5H3/b18-15+
InChIKey FRAHZCKRWFXRGO-OBGWFSINSA-N
Mol Weight 518.6 g/mol
Molecular Formula C29H42O8
Exact Mass 518.287968 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5SaR1X5DGfq
Name Methyl 2,4-diacetoxy-6-[10'-(acetoxy)-8'-pentadecenyl]-benzoate
Alternate Name(s) Methyl 2,4-bis(acetyloxy)-6-[(8E)-10-(acetyloxy)-8-pentadecenyl]benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H42O8
InChI InChI=1S/C29H42O8/c1-6-7-13-17-25(35-21(2)30)18-15-12-10-8-9-11-14-16-24-19-26(36-22(3)31)20-27(37-23(4)32)28(24)29(33)34-5/h15,18-20,25H,6-14,16-17H2,1-5H3/b18-15+
InChIKey FRAHZCKRWFXRGO-OBGWFSINSA-N
Molecular Weight 518.647 g/mol
SMILES c1(c(cc(cc1CCCCCCC\C=C\C(OC(=O)C)CCCCC)OC(=O)C)OC(=O)C)C(=O)OC
SPLASH splash10-0006-9500000000-8e005e50ed93f4a2a9e2
Source of Spectrum X2-56-1743-2
Wiley ID 1605122