SpectraBase Spectrum ID |
IWPaj4ymlfz |
Name |
1-(4-methoxyphenyl)-3,3-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)octan-1-one |
Appearance |
White sticky oil |
Carrier Gas |
Nitrogen |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
486.332399471 u |
Formula |
C27H44B2O6 |
GC Column |
HP-5 (30 m x 0.32 mm, film thickness 0.25 micrometer) |
InChI |
InChI=1S/C27H44B2O6/c1-11-12-13-18-27(28-32-23(2,3)24(4,5)33-28,29-34-25(6,7)26(8,9)35-29)19-22(30)20-14-16-21(31-10)17-15-20/h14-17H,11-13,18-19H2,1-10H3 |
InChIKey |
RBRUIAOQMMYVSF-UHFFFAOYSA-N |
Instrument Name |
Shimadzu 2014 with FID detector |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/chem.202301826 |
Molecular Weight |
486.263 g/mol |
Quality |
10 |
Reported Formula |
C27H44B2O6 |
SMILES |
CCCCCC(CC(C=1C=CC(=CC1)OC)=O)(B1OC(C(O1)(C)C)(C)C)B1OC(C(O1)(C)C)(C)C |
SPLASH |
splash10-0udi-0911000000-4595913dca2ba6a13160 |
Source of Spectrum |
QE-29-SM4-3aa (DOI: 10.1002/chem.202301826) |
Wiley ID |
1912022 |