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2-((4E)-4-Benzylideneoct-1-enyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

View entire compound with spectra: 1 MS (GC)

2-((4E)-4-Benzylideneoct-1-enyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
SpectraBase Compound ID 8rhtXf5OiM5
InChI InChI=1S/C21H31BO2/c1-6-7-12-18(17-19-13-9-8-10-14-19)15-11-16-22-23-20(2,3)21(4,5)24-22/h8-11,13-14,16-17H,6-7,12,15H2,1-5H3/b16-11-,18-17+
InChIKey RLAJOHAJTGMXAQ-FBFUSSJBSA-N
Mol Weight 326.3 g/mol
Molecular Formula C21H31BO2
Exact Mass 326.24171 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2culL2qgc9i
Name 2-((4E)-4-Benzylideneoct-1-enyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Alternate Name(s) 2-((1Z,4E)-4-benzylideneoct-1-en-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H31BO2
InChI InChI=1S/C21H31BO2/c1-6-7-12-18(17-19-13-9-8-10-14-19)15-11-16-22-23-20(2,3)21(4,5)24-22/h8-11,13-14,16-17H,6-7,12,15H2,1-5H3/b16-11-,18-17+
InChIKey RLAJOHAJTGMXAQ-FBFUSSJBSA-N
Literature Reference DOI 10.1021/ol102764w
Molecular Weight 326.287 g/mol
SMILES C1(C)(C)C(C)(C)OB(\C=C/C\C(=C\c2ccccc2)CCCC)O1
SPLASH splash10-00or-1921000000-b781416e0c3edddf9934
Source of Spectrum A1-13-304/SM5-3f
Wiley ID 1749832