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Methyl 11,12-butylborondioxyeicosan-5(Z),8(Z),14(Z)-trienoate
SpectraBase Compound ID 52oaBSyzJYx
InChI InChI=1S/C25H43BO4/c1-4-6-8-9-13-16-19-23-24(30-26(29-23)22-7-5-2)20-17-14-11-10-12-15-18-21-25(27)28-3/h10,12-14,16-17,23-24H,4-9,11,15,18-22H2,1-3H3/b12-10-,16-13-,17-14-
InChIKey ATQUCRTYMUJENG-GGYNFYSISA-N
Mol Weight 418.4 g/mol
Molecular Formula C25H43BO4
Exact Mass 418.32544 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9rEJie6GLk2
Name Methyl 11,12-butylborondioxyeicosan-5(Z),8(Z),14(Z)-trienoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H43BO4
InChI InChI=1S/C25H43BO4/c1-4-6-8-9-13-16-19-23-24(30-26(29-23)22-7-5-2)20-17-14-11-10-12-15-18-21-25(27)28-3/h10,12-14,16-17,23-24H,4-9,11,15,18-22H2,1-3H3/b12-10-,16-13-,17-14-
InChIKey ATQUCRTYMUJENG-GGYNFYSISA-N
Molecular Weight 418.425 g/mol
SMILES C1(OB(OC1C\C=C/CCCCC)CCCC)C\C=C/C\C=C/CCCC(=O)OC
SPLASH splash10-014i-9200000000-b20a5d86b8720218a44c
Source of Spectrum B3-0-101-1
Synonyms Methyl (5Z,8Z)-10-{2-butyl-5-[(2Z)-2-octenyl]-1,3,2-dioxaborolan-4-yl}-5,8-decadienoate
Wiley ID 1377345