| SpectraBase Spectrum ID |
80jEuz7kkR4 |
| Name |
(2S)-2-(4-bromophenyl)-4-(4-fluorophenyl)-2,3-dihydro-1,5-benzothiazepine |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H15BrFNS |
| InChI |
InChI=1S/C21H15BrFNS/c22-16-9-5-15(6-10-16)21-13-19(14-7-11-17(23)12-8-14)24-18-3-1-2-4-20(18)25-21/h1-12,21H,13H2/t21-/m0/s1 |
| InChIKey |
GIYDHRVUCOQPMF-NRFANRHFSA-N |
| Instrument Name |
AEI MS 30 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1016/j.arabjc.2013.12.024 |
| Molecular Weight |
412.320 g/mol |
| SMILES |
c1(Br)ccc(cc1)[C@]1(Sc2c(N=C(C1)c1ccc(cc1)F)cccc2)[H] |
| SPLASH |
splash10-000i-1090100000-193b23dbd240406678fe |
| Source of Spectrum |
AJC-10-S3257-4c |
| Wiley ID |
1857220 |
