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(E)-Benzyl 2-(3-bromophenyl)-1-(diethoxyphosphoryl)vinylcarbamate
SpectraBase Compound ID 3H2ULb8UWls
InChI InChI=1S/C20H23BrNO5P/c1-3-26-28(24,27-4-2)19(14-17-11-8-12-18(21)13-17)22-20(23)25-15-16-9-6-5-7-10-16/h5-14H,3-4,15H2,1-2H3,(H,22,23)/b19-14+
InChIKey KHACKJGTJZTGAQ-XMHGGMMESA-N
Mol Weight 468.28 g/mol
Molecular Formula C20H23BrNO5P
Exact Mass 467.049723 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CJK2TyIdWSp
Name (E)-Benzyl 2-(3-bromophenyl)-1-(diethoxyphosphoryl)vinylcarbamate
Alternate Name(s) benzyl (E)-(2-(3-bromophenyl)-1-(diethoxyphosphoryl)vinyl)carbamate
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Formula C20H23BrNO5P
InChI InChI=1S/C20H23BrNO5P/c1-3-26-28(24,27-4-2)19(14-17-11-8-12-18(21)13-17)22-20(23)25-15-16-9-6-5-7-10-16/h5-14H,3-4,15H2,1-2H3,(H,22,23)/b19-14+
InChIKey KHACKJGTJZTGAQ-XMHGGMMESA-N
Literature Reference DOI 10.1002/anie.201104912
Molecular Weight 468.284 g/mol
SMILES N(\C(=C/c1cccc(c1)Br)P(OCC)(=O)OCC)C(=O)OCc1ccccc1
SPLASH splash10-01ox-9312000000-03c997f24b4a60183a9e
Source of Spectrum ACI-50-SM8-3d
Wiley ID 1780123