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CIS-4-[(2-BROMO-1,1-DIMETHYL)-ETHYL]-3-METHOXY-1-(1-VINYLCYCLOPROPYL)-AZETIDIN-2-ONE
SpectraBase Compound ID FjDNkncI6Y3
InChI InChI=1S/C13H20BrNO2/c1-5-13(6-7-13)15-10(12(2,3)8-14)9(17-4)11(15)16/h5,9-10H,1,6-8H2,2-4H3/t9-,10-/m1/s1
InChIKey OWSQJYMUVMCXCD-NXEZZACHSA-N
Mol Weight 302.21 g/mol
Molecular Formula C13H20BrNO2
Exact Mass 301.067742 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ICB2PFYZOg2
Name (3S,4R)-1-(1-Vinylcyclopropyl)-4-[(2-bromo-1,1-dimethyl)ethyl]-3-methoxyazetidin-2-one
Comments Edited after expert review for CH2Cl2 contamination - Original record with SpectrumID 1595526 moved to the Legacy library
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Formula C13H20BrNO2
InChI InChI=1S/C13H20BrNO2/c1-5-13(6-7-13)15-10(12(2,3)8-14)9(17-4)11(15)16/h5,9-10H,1,6-8H2,2-4H3/t9-,10-/m1/s1
InChIKey OWSQJYMUVMCXCD-NXEZZACHSA-N
Molecular Weight 302.212 g/mol
SMILES C1(N([C@]([C@]1(OC)[H])(C(CBr)(C)C)[H])C1(CC1)C=C)=O
SPLASH splash10-0002-9500000000-e757511f528a9a98db63
Source of Spectrum F-69-5983-8
Synonyms (3R,4S)-4-(2-bromo-1,1-dimethylethyl)-3-methoxy-1-(1-vinylcyclopropyl)-2-azetidinone cis-1-(1-Vinylcyclopropyl)-4-[(2-bromo-1,1-dimethyl)ethyl]-3-methoxyazetidin-2-one
Wiley ID 1821301