| SpectraBase Spectrum ID |
6Gc4JeMjPP1 |
| Name |
4-(3-BROMOBENZOYL)-N-BUTYL-2-ISOBUTYL-2,3,4,5-TETRAHYDROBENZO-[F]-[1,4]-OXAZEPINE-5-CARBOXAMIDE;MAJOR-ROTAMER |
| Compound Number |
13G |
| Copyright |
Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula |
C25H31BrN2O3 |
| InChI |
InChI=1S/C25H31BrN2O3/c1-4-5-13-27-24(29)23-21-11-6-7-12-22(21)31-20(14-17(2)3)16-28(23)25(30)18-9-8-10-19(26)15-18/h6-12,15,17,20,23H,4-5,13-14,16H2,1-3H3,(H,27,29)/t20-,23+/m0/s1 |
| InChIKey |
WNRGIRGHJPQQFK-NZQKXSOJSA-N |
| Literature Reference Author |
L.BANFI,A.BAGNO,A.BASSO,C.D.SANTIS,R.RIVA,F.RASTRELLI |
| Literature Reference Citation |
EUR.J.ORG.CHEM.,2013,5064(2013) |
| Literature Reference DOI |
10.1002/ejoc.201300541 |
| Molecular Weight |
487.437 g/mol |
| Solvent |
DMSO-D6 |
| Source File Reference |
UWBT18260 |
![4-(3-BROMOBENZOYL)-N-BUTYL-2-ISOBUTYL-2,3,4,5-TETRAHYDROBENZO-[F]-[1,4]-OXAZEPINE-5-CARBOXAMIDE;MAJOR-ROTAMER](/api/spectrum/6Gc4JeMjPP1/structure.png?h=300&w=458 "4-(3-BROMOBENZOYL)-N-BUTYL-2-ISOBUTYL-2,3,4,5-TETRAHYDROBENZO-[F]-[1,4]-OXAZEPINE-5-CARBOXAMIDE;MAJOR-ROTAMER")
