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(E)-10-(1',1'-Bis(ethoxycarbonyl)ethyl)-10-octadecen-8-one
SpectraBase Compound ID KBQZNjxVB5m
InChI InChI=1S/C26H46O5/c1-6-10-12-14-16-17-19-22(21-23(27)20-18-15-13-11-7-2)26(5,24(28)30-8-3)25(29)31-9-4/h19H,6-18,20-21H2,1-5H3/b22-19+
InChIKey GHRSHSQMUPVTQP-ZBJSNUHESA-N
Mol Weight 438.6 g/mol
Molecular Formula C26H46O5
Exact Mass 438.334525 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F6nGmYMCJg3
Name (E)-10-(1',1'-Bis(ethoxycarbonyl)ethyl)-10-octadecen-8-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H46O5
InChI InChI=1S/C26H46O5/c1-6-10-12-14-16-17-19-22(21-23(27)20-18-15-13-11-7-2)26(5,24(28)30-8-3)25(29)31-9-4/h19H,6-18,20-21H2,1-5H3/b22-19+
InChIKey GHRSHSQMUPVTQP-ZBJSNUHESA-N
Molecular Weight 438.649 g/mol
SMILES C(\C(CC(=O)CCCCCCC)=C\CCCCCCC)(C(=O)OCC)(C(=O)OCC)C
SPLASH splash10-014i-0090000000-ff7d51c1c5caa0dde569
Source of Spectrum KC-61-4161-5
Synonyms diethyl 2-methyl-2-[(1E)-1-(2-oxononyl)-1-nonenyl]malonate
Wiley ID 1628861