| SpectraBase Spectrum ID |
17xtJjaJsBF |
| Name |
[2S-(2.alpha.,3.beta.,4.alpha.)]-3-Bromotetrahydro-4-[(phenylmethyl)amino]-2-thiophenepentanoic Acid Methyl Ester |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H24BrNO2S |
| InChI |
InChI=1S/C17H24BrNO2S/c1-21-16(20)10-6-5-9-15-17(18)14(12-22-15)19-11-13-7-3-2-4-8-13/h2-4,7-8,14-15,17,19H,5-6,9-12H2,1H3/t14-,15-,17+/m0/s1 |
| InChIKey |
MDEWMSXXRGCQKG-YQQAZPJKSA-N |
| Molecular Weight |
386.348 g/mol |
| SMILES |
N([C@]1(CS[C@]([C@@]1(Br)[H])(CCCCC(=O)OC)[H])[H])Cc1ccccc1 |
| SPLASH |
splash10-006x-9093000000-26be8252a76041f87f11 |
| Source of Spectrum |
J-60-329-28 |
| Synonyms |
Methyl 5-[(2S,3R,4S)-4-(benzylamino)-3-bromotetrahydro-2-thienyl]pentanoate |
| Wiley ID |
1362112 |
![[2S-(2.alpha.,3.beta.,4.alpha.)]-3-Bromotetrahydro-4-[(phenylmethyl)amino]-2-thiophenepentanoic Acid Methyl Ester](/api/spectrum/17xtJjaJsBF/structure.png?h=300&w=458 "[2S-(2.alpha.,3.beta.,4.alpha.)]-3-Bromotetrahydro-4-[(phenylmethyl)amino]-2-thiophenepentanoic Acid Methyl Ester")
