| SpectraBase Spectrum ID |
3B7ivTyNnvU |
| Name |
(1S,3S,10aR)-(+-)-3-Trifluoroacetylamino-1-hydroxy-1-phenylperhydropyrido[1,2-a]azepin-4-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H21F3N2O3 |
| InChI |
InChI=1S/C18H21F3N2O3/c19-18(20,21)16(25)22-13-11-17(26,12-7-3-1-4-8-12)14-9-5-2-6-10-23(14)15(13)24/h1,3-4,7-8,13-14,26H,2,5-6,9-11H2,(H,22,25)/t13-,14+,17-/m0/s1 |
| InChIKey |
MRNWKSYOANBTQM-VBQJREDUSA-N |
| Molecular Weight |
370.372 g/mol |
| SMILES |
N(C(C(F)(F)F)=O)[C@@]1(C(N2[C@@]([C@](C1)(c1ccccc1)O)(CCCCC2)[H])=O)[H] |
| SPLASH |
splash10-002b-9200000000-e48ff09d79c8a09cdaa4 |
| Source of Spectrum |
QC-9-4470-7 |
| Synonyms |
N-[(1S,3S,10aR)-1-hydroxy-4-oxo-1-phenyldecahydropyrido[1,2-a]azepin-3-yl]-2,2,2-trifluoroacetamide |
| Wiley ID |
870944 |
![(1S,3S,10aR)-(+-)-3-Trifluoroacetylamino-1-hydroxy-1-phenylperhydropyrido[1,2-a]azepin-4-one](/api/spectrum/3B7ivTyNnvU/structure.png?h=300&w=458 "(1S,3S,10aR)-(+-)-3-Trifluoroacetylamino-1-hydroxy-1-phenylperhydropyrido[1,2-a]azepin-4-one")
