SpectraBase Spectrum ID |
9I6NoHEFmUN |
Name |
(5S)-2,2-Bis(trifluoromethyl)-[N-(9-fluorenylmethoxycarbonyl)phenylalanylaminomethyl]-5-methyl-1,3-dioxolan-4-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C31H26F6N2O6 |
InChI |
InChI=1S/C31H26F6N2O6/c1-28(26(41)44-29(45-28,30(32,33)34)31(35,36)37)17-38-25(40)24(15-18-9-3-2-4-10-18)39-27(42)43-16-23-21-13-7-5-11-19(21)20-12-6-8-14-22(20)23/h2-14,23-24H,15-17H2,1H3,(H,38,40)(H,39,42)/t24-,28-/m0/s1 |
InChIKey |
JXLKAJBBRNPNCJ-CUBQBAPOSA-N |
Molecular Weight |
636.547 g/mol |
SMILES |
N(C([C@@](NC(OCC1c2c(cccc2)-c2c1cccc2)=O)(Cc1ccccc1)[H])=O)C[C@@]1(OC(OC1=O)(C(F)(F)F)C(F)(F)F)C |
SPLASH |
splash10-004i-4900002000-78e45e48d7b3a31f7b54 |
Source of Spectrum |
SO-0-1279-9 |
Synonyms |
9H-fluoren-9-ylmethyl (1S)-1-benzyl-2-({[(4S)-4-methyl-5-oxo-2,2-bis(trifluoromethyl)-1,3-dioxolan-4-yl]methyl}amino)-2-oxoethylcarbamate |
Wiley ID |
874047 |