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Benzamide, N-[tetrahydro-6-(iodomethylene)-2-oxo-4-phenyl-2H-pyran-3-yl]-, (3.alpha.,4.beta.,6E)-
SpectraBase Compound ID BgE0VhQ6mXl
InChI InChI=1S/C19H16INO3/c20-12-15-11-16(13-7-3-1-4-8-13)17(19(23)24-15)21-18(22)14-9-5-2-6-10-14/h1-10,12,16-17H,11H2,(H,21,22)/b15-12+/t16-,17-/m1/s1
InChIKey OLRDCKKZMGEPFD-OMYPGEHRSA-N
Mol Weight 433.25 g/mol
Molecular Formula C19H16INO3
Exact Mass 433.017488 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5h64XcQ7SzR
Name Benzamide, N-[tetrahydro-6-(iodomethylene)-2-oxo-4-phenyl-2H-pyran-3-yl]-, (3.alpha.,4.beta.,6E)-
CAS Registry Number 96666-76-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16INO3
InChI InChI=1S/C19H16INO3/c20-12-15-11-16(13-7-3-1-4-8-13)17(19(23)24-15)21-18(22)14-9-5-2-6-10-14/h1-10,12,16-17H,11H2,(H,21,22)/b15-12+/t16-,17-/m1/s1
InChIKey OLRDCKKZMGEPFD-OMYPGEHRSA-N
Molecular Weight 433.245 g/mol
SMILES N([C@]1(C(O\C(C[C@@]1(c1ccccc1)[H])=C/I)=O)[H])C(=O)c1ccccc1
SPLASH splash10-0a4i-7900000000-292784565a78800bd3e5
Source of Spectrum J-50-2336-14
Synonyms (3R*,4R*)-3-benzamido-4-phenyl-6(E)-(iodomethylene)tetrahydro-2-pyranone N-[(3R,4R,6E)-6-(iodomethylene)-2-oxo-4-phenyltetrahydro-2H-pyran-3-yl]benzamide
Wiley ID 1382613