SpectraBase Spectrum ID |
21kOIYbI |
Name |
4-cyclohexyl-1-(4-methoxyphenyl)-3,3-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)butan-1-one |
Appearance |
White foam |
Carrier Gas |
Nitrogen |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
512.348049535 u |
Formula |
C29H46B2O6 |
GC Column |
HP-5 (30 m x 0.32 mm, film thickness 0.25 micrometer) |
InChI |
InChI=1S/C29H46B2O6/c1-25(2)26(3,4)35-30(34-25)29(19-21-13-11-10-12-14-21,31-36-27(5,6)28(7,8)37-31)20-24(32)22-15-17-23(33-9)18-16-22/h15-18,21H,10-14,19-20H2,1-9H3 |
InChIKey |
NIFKSRUKSPPHSU-UHFFFAOYSA-N |
Instrument Name |
Shimadzu 2014 with FID detector |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/chem.202301826 |
Molecular Weight |
512.301 g/mol |
Quality |
44 |
Reported Formula |
C29H46B2O6 |
SMILES |
COC1=CC=C(C=C1)C(=O)CC(B1OC(C(O1)(C)C)(C)C)(B1OC(C(O1)(C)C)(C)C)CC1CCCCC1 |
SPLASH |
splash10-0udi-2910000000-47d4b397296385301860 |
Source of Spectrum |
QE-29-SM7-3ia (DOI: 10.1002/chem.202301826) |
Wiley ID |
1912040 |