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(5RS,5aRS,11aSR,11bSR)-5-Bromodecahydro-1H-oxepino[3',4':4,5]isoxazolo[2,3-a]pyridin-1-one
SpectraBase Compound ID LkNSglaoV1Q
InChI InChI=1S/C11H16BrNO3/c12-7-4-6-15-11(14)9-8-3-1-2-5-13(8)16-10(7)9/h7-10H,1-6H2
InChIKey IYSQLOPQEYSCQU-UHFFFAOYSA-N
Mol Weight 290.16 g/mol
Molecular Formula C11H16BrNO3
Exact Mass 289.031356 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7mmgZpBDKtf
Name (5RS,5aRS,11aSR,11bSR)-5-Bromodecahydro-1H-oxepino[3',4':4,5]isoxazolo[2,3-a]pyridin-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16BrNO3
InChI InChI=1S/C11H16BrNO3/c12-7-4-6-15-11(14)9-8-3-1-2-5-13(8)16-10(7)9/h7-10H,1-6H2
InChIKey IYSQLOPQEYSCQU-UHFFFAOYSA-N
Molecular Weight 290.157 g/mol
SMILES C12C(C3CCCCN3O2)C(OCCC1Br)=O
SPLASH splash10-007n-9510000000-70127cfe30b5e1131ada
Source of Spectrum H1-40-395-13
Wiley ID 756885