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(5RS,5aRS,12aSR,12bSR)-5-Acetoxy-7-thioxodecahydro-1H,7H-oxepino[3,4-e]pyrido[1,2-e]oxazin-1-one

View entire compound with spectra: 1 MS (GC)

(5RS,5aRS,12aSR,12bSR)-5-Acetoxy-7-thioxodecahydro-1H,7H-oxepino[3,4-e]pyrido[1,2-e]oxazin-1-one
SpectraBase Compound ID 89ZfS3fo6Fr
InChI InChI=1S/C14H19NO5S/c1-8(16)19-10-5-7-18-13(17)11-9-4-2-3-6-15(9)14(21)20-12(10)11/h9-12H,2-7H2,1H3/t9-,10+,11-,12-/m1/s1
InChIKey SBSNKJSMHAGMRT-WRWGMCAJSA-N
Mol Weight 313.37 g/mol
Molecular Formula C14H19NO5S
Exact Mass 313.098394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 22fTTiaihS0
Name (5RS,5aRS,12aSR,12bSR)-5-Acetoxy-7-thioxodecahydro-1H,7H-oxepino[3,4-e]pyrido[1,2-e]oxazin-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H19NO5S
InChI InChI=1S/C14H19NO5S/c1-8(16)19-10-5-7-18-13(17)11-9-4-2-3-6-15(9)14(21)20-12(10)11/h9-12H,2-7H2,1H3/t9-,10+,11-,12-/m1/s1
InChIKey SBSNKJSMHAGMRT-WRWGMCAJSA-N
Molecular Weight 313.368 g/mol
SMILES C1(N2[C@@](CCCC2)([H])[C@@]2([C@](O1)([C@@](OC(=O)C)(CCOC2=O)[H])[H])[H])=S
SPLASH splash10-01px-9022000000-873d51c65d8fecb362fb
Source of Spectrum K1-2004-4224-23
Wiley ID 1561691