SpectraBase Spectrum ID |
1dhYVnQ1Z4c |
Name |
(alpha-S)-alpha-Methoxy-alpha-(trifluoromethyl)benzeneacetic acid (1S)-1-{2-[4-(Phenylmethoxy)phenyl]ethyl}-but-3-en-1-yl Ester |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C29H29F3O4 |
InChI |
InChI=1S/C29H29F3O4/c1-3-10-26(36-27(33)28(34-2,29(30,31)32)24-13-8-5-9-14-24)20-17-22-15-18-25(19-16-22)35-21-23-11-6-4-7-12-23/h3-9,11-16,18-19,26H,1,10,17,20-21H2,2H3/t26-,28+/m1/s1 |
InChIKey |
CYTIEVNOUXWQQJ-IAPPQJPRSA-N |
Literature Reference DOI |
10.1002/hlca.201000096 |
Molecular Weight |
498.542 g/mol |
SMILES |
C(c1ccc(cc1)OCc1ccccc1)C[C@@](CC=C)(OC(=O)[C@](OC)(C(F)(F)F)c1ccccc1)[H] |
SPLASH |
splash10-0006-9100000000-b4c9822afdc2337fb46b |
Source of Spectrum |
H-93-1291-9 |
Synonyms |
(3S)-1-[4-(Benzyloxy)phenyl]hex-5-en-3-yl (2S)-3,3,3-Trifluoro-2-methoxy-2-phenylpropanoate
(S)-1-(4-(benzyloxy)phenyl)hex-5-en-3-yl (S)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoate |
Wiley ID |
1783999 |