SpectraBase Spectrum ID |
AOME8Gpxouq |
Name |
1,3,5-Tris[(4(S)-phenylmethyl-2-oxazolinyl)methyl]-2,4,6-trimethylbenzene |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C42H45N3O3 |
InChI |
InChI=1S/C42H45N3O3/c1-28-37(22-40-43-34(25-46-40)19-31-13-7-4-8-14-31)29(2)39(24-42-45-36(27-48-42)21-33-17-11-6-12-18-33)30(3)38(28)23-41-44-35(26-47-41)20-32-15-9-5-10-16-32/h4-18,34-36H,19-27H2,1-3H3/t34-,35-,36-/m0/s1 |
InChIKey |
GDCPZJPNRGABMA-KVBYWJEESA-N |
Molecular Weight |
639.840 g/mol |
SMILES |
c1(c(c(CC2=N[C@@](Cc3ccccc3)(CO2)[H])c(c(c1C)CC1=N[C@@](Cc2ccccc2)(CO1)[H])C)C)CC1=N[C@@](Cc2ccccc2)(CO1)[H] |
SPLASH |
splash10-000e-0000069000-a761ea8e4baac6ea5c91 |
Source of Spectrum |
QE-6-3402-5 |
Synonyms |
(4S)-4-benzyl-2-(3,5-bis{[(4S)-4-benzyl-4,5-dihydro-1,3-oxazol-2-yl]methyl}-2,4,6-trimethylbenzyl)-4,5-dihydro-1,3-oxazole |
Wiley ID |
845130 |