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1-(4-methoxyphenyl)-5-phenyl-3,3-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pentan-1-one
SpectraBase Compound ID 37s2vYZV6IH
InChI InChI=1S/C30H42B2O6/c1-26(2)27(3,4)36-31(35-26)30(20-19-22-13-11-10-12-14-22,32-37-28(5,6)29(7,8)38-32)21-25(33)23-15-17-24(34-9)18-16-23/h10-18H,19-21H2,1-9H3
InChIKey USUFBHUTQXCOTO-UHFFFAOYSA-N
Mol Weight 520.3 g/mol
Molecular Formula C30H42B2O6
Exact Mass 520.316749 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KNiixdg2oiw
Name 1-(4-methoxyphenyl)-5-phenyl-3,3-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pentan-1-one
Appearance White foam
Carrier Gas Nitrogen
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 520.316749406 u
Formula C30H42B2O6
GC Column HP-5 (30 m x 0.32 mm, film thickness 0.25 micrometer)
InChI InChI=1S/C30H42B2O6/c1-26(2)27(3,4)36-31(35-26)30(20-19-22-13-11-10-12-14-22,32-37-28(5,6)29(7,8)38-32)21-25(33)23-15-17-24(34-9)18-16-23/h10-18H,19-21H2,1-9H3
InChIKey USUFBHUTQXCOTO-UHFFFAOYSA-N
Instrument Name Shimadzu 2014 with FID detector
Ionization Type EI
Literature Reference DOI 10.1002/chem.202301826
Molecular Weight 520.280 g/mol
Quality 12
Reported Formula C30H42B2O6
SMILES COC1=CC=C(C=C1)C(=O)CC(B1OC(C(O1)(C)C)(C)C)(B1OC(C(O1)(C)C)(C)C)CCC1=CC=CC=C1
SPLASH splash10-0udi-0906200000-b4775952c644c2c5de16
Source of Spectrum QE-29-SM7-3ka (DOI: 10.1002/chem.202301826)
Wiley ID 1912042