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Cyclopentanepropanoic acid, 3,5-bis(acetyloxy)-2-[3-(acetyloxy)octyl]-, methyl ester
SpectraBase Compound ID 7eI47Kaha1t
InChI InChI=1S/C23H38O8/c1-6-7-8-9-18(29-15(2)24)10-11-19-20(12-13-23(27)28-5)22(31-17(4)26)14-21(19)30-16(3)25/h18-22H,6-14H2,1-5H3
InChIKey GNUMDPBLFNWUEB-UHFFFAOYSA-N
Mol Weight 442.5 g/mol
Molecular Formula C23H38O8
Exact Mass 442.256668 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7BTpGwrlyl3
Name Cyclopentanepropanoic acid, 3,5-bis(acetyloxy)-2-[3-(acetyloxy)octyl]-, methyl ester
CAS Registry Number 55401-45-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H38O8
InChI InChI=1S/C23H38O8/c1-6-7-8-9-18(29-15(2)24)10-11-19-20(12-13-23(27)28-5)22(31-17(4)26)14-21(19)30-16(3)25/h18-22H,6-14H2,1-5H3
InChIKey GNUMDPBLFNWUEB-UHFFFAOYSA-N
Molecular Weight 442.549 g/mol
SMILES C1(C(C(CCC(=O)OC)C(C1)OC(=O)C)CCC(OC(=O)C)CCCCC)OC(=O)C
SPLASH splash10-03di-0690000000-1437ddfc2ae335e6ad04
Source of Spectrum W-19-545-10
Synonyms Methyl 3-(2-(3-acetoxyoctyl)-3.alpha.,5.alpha.-diacetoxycyclopentyl)propanoate Methyl 3-{3,5-bis(acetyloxy)-2-[3-(acetyloxy)octyl]cyclopentyl}propanoate 3-[3,5-diacetyloxy-2-(3-acetyloxyoctyl)cyclopentyl]propanoic acid methyl ester Methyl 3-[3,5-diacetoxy-2-(3-acetoxyoctyl)cyclopentyl]propanoate Methyl 3-[3,5-diacetyloxy-2-(3-acetyloxyoctyl)cyclopentyl]propanoate
Wiley ID 60144