| SpectraBase Spectrum ID |
7PXPBkIbqvs |
| Name |
(2S,4R)-Ethyl 2-[5-bromo-2-ethoxy-6-hydroxy-1-(4-methylphenylsulfonyl)-4-piperidinyl]acetate |
| Appearance |
Colorless needles |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
463.066421729 u |
| Formula |
C18H26BrNO6S |
| InChI |
InChI=1S/C18H26BrNO6S/c1-4-25-15-10-13(11-16(21)26-5-2)17(19)18(22)20(15)27(23,24)14-8-6-12(3)7-9-14/h6-9,13,15,17-18,22H,4-5,10-11H2,1-3H3/t13-,15+,17?,18?/m1/s1 |
| InChIKey |
FIULCEOZGFOKKG-OSNKYIGBSA-N |
| Instrument Name |
JEOL JMS-DX303 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3998/ark.5550190.0004.823 |
| Molecular Weight |
464.371 g/mol |
| Quality |
11 |
| Reported Formula |
C18H26NO6S(79)Br |
| SMILES |
OC1N([C@](C[C@](CC(OCC)=O)(C1Br)[H])(OCC)[H])S(C1=CC=C(C=C1)C)(=O)=O |
| SPLASH |
splash10-00di-9000000000-f8011b40697c1fe3fa86 |
| Source of Spectrum |
ARK-2003-243-21 (DOI: 10.3998/ark.5550190.0004.823) |
| Wiley ID |
1900058 |
![(2S,4R)-Ethyl 2-[5-bromo-2-ethoxy-6-hydroxy-1-(4-methylphenylsulfonyl)-4-piperidinyl]acetate](/api/spectrum/7PXPBkIbqvs/structure.png?h=300&w=458 "(2S,4R)-Ethyl 2-[5-bromo-2-ethoxy-6-hydroxy-1-(4-methylphenylsulfonyl)-4-piperidinyl]acetate")
