SpectraBase Spectrum ID |
9SjNyAUzstg |
Name |
[3,5-Bis-((S)-4-isopropyl-4,5-dihydro-oxazol-2-ylmethyl)-2,4,6-trimethyl-phenyl]-acetonitrile |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C25H35N3O2 |
InChI |
InChI=1S/C25H35N3O2/c1-14(2)22-12-29-24(27-22)10-20-16(5)19(8-9-26)17(6)21(18(20)7)11-25-28-23(13-30-25)15(3)4/h14-15,22-23H,8,10-13H2,1-7H3/t22-,23-/m1/s1 |
InChIKey |
MNKMQACFTSFYQC-DHIUTWEWSA-N |
Molecular Weight |
409.574 g/mol |
SMILES |
c1(c(c(CC2=N[C@@](C(C)C)(CO2)[H])c(c(c1C)CC#N)C)C)CC1=N[C@@](C(C)C)(CO1)[H] |
SPLASH |
splash10-066r-0009600000-b031b8d400bde03f5423 |
Source of Spectrum |
Y1-45-6837-1 |
Synonyms |
(3,5-bis{[(4S)-4-isopropyl-4,5-dihydro-1,3-oxazol-2-yl]methyl}-2,4,6-trimethylphenyl)acetonitrile
1,3-Bis(4-isopropyloxazolin-2-yl)methyl-2,4,6-trimethyl-5-cyanomethylbenzene |
Wiley ID |
1622185 |