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(3-hydroxy-3-phenyl-4-[(4-phenylpiperidin-1-yl)methyl]pyrrolidin-1-yl)(2-iodophenyl)methanone
SpectraBase Compound ID 1gBlNJXzNsX
InChI InChI=1S/C29H31IN2O2/c30-27-14-8-7-13-26(27)28(33)32-20-25(29(34,21-32)24-11-5-2-6-12-24)19-31-17-15-23(16-18-31)22-9-3-1-4-10-22/h1-14,23,25,34H,15-21H2
InChIKey TXPJJRKQTYOEKX-UHFFFAOYSA-N
Mol Weight 566.48 g/mol
Molecular Formula C29H31IN2O2
Exact Mass 566.143023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BgrWhGvjdVK
Name (3-hydroxy-3-phenyl-4-[(4-phenylpiperidin-1-yl)methyl]pyrrolidin-1-yl)(2-iodophenyl)methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H31IN2O2
InChI InChI=1S/C29H31IN2O2/c30-27-14-8-7-13-26(27)28(33)32-20-25(29(34,21-32)24-11-5-2-6-12-24)19-31-17-15-23(16-18-31)22-9-3-1-4-10-22/h1-14,23,25,34H,15-21H2
InChIKey TXPJJRKQTYOEKX-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 566.483 g/mol
SMILES OC1(CN(CC1CN1CCC(CC1)c1ccccc1)C(c1ccccc1I)=O)c1ccccc1
SPLASH splash10-00di-0900000000-7115552bfacff2301cd0
Source of Spectrum CA2569861C
Wiley ID 1841377