(1R,3S,10aR)-(+-)-3-Trifluoroacetylamino-1-hydroxy-1-phenylperhydropyrido[1,2-a]azepin-4-one

SpectraBase Compound ID	GdRkN5oRm13
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-JJRVBVJISA-N Google Search
Mol Weight	370.37 g/mol
Molecular Formula	C18H21F3N2O3
Exact Mass	370.150427 g/mol

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SpectraBase Spectrum ID	AARLx8zL3uN
Name	(1R,3S,10aR)-(+-)-3-Trifluoroacetylamino-1-hydroxy-1-phenylperhydropyrido[1,2-a]azepin-4-one
Alternate Name(s)	N-[(1R,3S,10aR)-1-hydroxy-4-oxo-1-phenyldecahydropyrido[1,2-a]azepin-3-yl]-2,2,2-trifluoroacetamide
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-JJRVBVJISA-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	splash10-0002-9220000000-b185fb24c2f19a6aee68
Source of Spectrum	QC-9-4469-6
Wiley ID	870945