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(3SR,4RS)-4-(4-Bromophenyl)-3-(3-phenylpropyl)-1-methoxycarbonylmethyl-azetidin-2-one
SpectraBase Compound ID FXAGN2oT0LT
InChI InChI=1S/C21H22BrNO3/c1-26-19(24)14-23-20(16-10-12-17(22)13-11-16)18(21(23)25)9-5-8-15-6-3-2-4-7-15/h2-4,6-7,10-13,18,20H,5,8-9,14H2,1H3/t18-,20-/m1/s1
InChIKey NNHPWKXRMNJQIT-UYAOXDASSA-N
Mol Weight 416.32 g/mol
Molecular Formula C21H22BrNO3
Exact Mass 415.078307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bwzvw7Iy3xH
Name (3SR,4RS)-4-(4-Bromophenyl)-3-(3-phenylpropyl)-1-methoxycarbonylmethyl-azetidin-2-one
Alternate Name(s) Methyl 2-((2S,3R)-2-(4-bromophenyl)-4-oxo-3-(3-phenylpropyl)azetidin-1-yl)acetate
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Formula C21H22BrNO3
InChI InChI=1S/C21H22BrNO3/c1-26-19(24)14-23-20(16-10-12-17(22)13-11-16)18(21(23)25)9-5-8-15-6-3-2-4-7-15/h2-4,6-7,10-13,18,20H,5,8-9,14H2,1H3/t18-,20-/m1/s1
InChIKey NNHPWKXRMNJQIT-UYAOXDASSA-N
Molecular Weight 416.315 g/mol
SMILES C1(N([C@@]([C@]1(CCCc1ccccc1)[H])(c1ccc(cc1)Br)[H])CC(=O)OC)=O
SPLASH splash10-00kf-8900000000-9b04873a2b2cf1a81c6d
Source of Spectrum F-68-10784-8da
Wiley ID 1737382