| SpectraBase Spectrum ID |
BSCMLpUtDkd |
| Name |
Isobutyl (3S,4R,5S)-1-Benzyl-5-chloro-4-(4-fluorophenyl)piperidine-3-carboxylate |
| Alternate Name(s) |
isobutyl (3S,4R,5S)-1-benzyl-5-chloro-4-(4-fluorophenyl)-3-piperidinecarboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H27ClFNO2 |
| InChI |
InChI=1S/C23H27ClFNO2/c1-16(2)15-28-23(27)20-13-26(12-17-6-4-3-5-7-17)14-21(24)22(20)18-8-10-19(25)11-9-18/h3-11,16,20-22H,12-15H2,1-2H3/t20-,21-,22+/m1/s1 |
| InChIKey |
VCJWDXNXYLGUHT-VSKRKVRLSA-N |
| Molecular Weight |
403.925 g/mol |
| SMILES |
C1N(C[C@]([C@]([C@@]1(C(=O)OCC(C)C)[H])(c1ccc(cc1)F)[H])(Cl)[H])Cc1ccccc1 |
| SPLASH |
splash10-00kf-5019000000-21d2102360e709fa9d1a |
| Source of Spectrum |
U1-2002-3548-15 |
| Wiley ID |
1523343 |
