SpectraBase Spectrum ID |
IX9ruZaqTR1 |
Name |
(2S,3S,5R)-3-Acetoxy-1-ethoxycarbonyl-2-benzyl-5-nonylpyrrolidine |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C25H39NO4 |
InChI |
InChI=1S/C25H39NO4/c1-4-6-7-8-9-10-14-17-22-19-24(30-20(3)27)23(26(22)25(28)29-5-2)18-21-15-12-11-13-16-21/h11-13,15-16,22-24H,4-10,14,17-19H2,1-3H3/t22-,23+,24+/m1/s1 |
InChIKey |
YGAUTTJKENBQTD-SGNDLWITSA-N |
Molecular Weight |
417.590 g/mol |
SMILES |
[C@@]1(N([C@@](C[C@@]1(OC(=O)C)[H])(CCCCCCCCC)[H])C(=O)OCC)(Cc1ccccc1)[H] |
SPLASH |
splash10-004i-0019000000-dd51281997ec6db7f7f5 |
Source of Spectrum |
KC-0-269-24 |
Synonyms |
Ethyl (2S,3S,5R)-3-(acetyloxy)-2-benzyl-5-nonyl-1-pyrrolidinecarboxylate |
Wiley ID |
827378 |