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(S,E)-Methyl 4-[(2-Iodobenzoyl)amino]-5-phenyl-2-pentenoate
SpectraBase Compound ID H3fuLk8raWQ
InChI InChI=1S/C19H18INO3/c1-24-18(22)12-11-15(13-14-7-3-2-4-8-14)21-19(23)16-9-5-6-10-17(16)20/h2-12,15H,13H2,1H3,(H,21,23)/b12-11+/t15-/m1/s1
InChIKey WZRQKSSQNXGKNA-AYJWMTRPSA-N
Mol Weight 435.26 g/mol
Molecular Formula C19H18INO3
Exact Mass 435.033138 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5DvmbZ92sbp
Name (S,E)-Methyl 4-[(2-Iodobenzoyl)amino]-5-phenyl-2-pentenoate
Alternate Name(s) (S,E)-methyl 4-(2-iodobenzamido)-5-phenylpent-2-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18INO3
InChI InChI=1S/C19H18INO3/c1-24-18(22)12-11-15(13-14-7-3-2-4-8-14)21-19(23)16-9-5-6-10-17(16)20/h2-12,15H,13H2,1H3,(H,21,23)/b12-11+/t15-/m1/s1
InChIKey WZRQKSSQNXGKNA-AYJWMTRPSA-N
Literature Reference DOI 10.1002_1615-4169(20010430)343_4_360
Molecular Weight 435.261 g/mol
SMILES N(C(c1c(I)cccc1)=O)[C@](\C=C\C(OC)=O)(Cc1ccccc1)[H]
SPLASH splash10-001l-1295000000-f7b2e876efc4d55d70e4
Source of Spectrum ASC-343-364-4c
Wiley ID 1767134