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(+-)-trans-2-Hydroxy-3-[4-(4'-iodophenyl)piperidino]tetralin [(+-)-4'-iodobenzovesamicol]
SpectraBase Compound ID DhaVd5G3vw6
InChI InChI=1S/C21H24INO/c22-19-7-5-15(6-8-19)16-9-11-23(12-10-16)20-13-17-3-1-2-4-18(17)14-21(20)24/h1-8,16,20-21,24H,9-14H2/t20-,21-/m1/s1
InChIKey FDIYSOBTQZCZBV-NHCUHLMSSA-N
Mol Weight 433.33 g/mol
Molecular Formula C21H24INO
Exact Mass 433.090259 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lakn0Z7dhwF
Name (+-)-trans-2-Hydroxy-3-[4-(4'-iodophenyl)piperidino]tetralin [(+-)-4'-iodobenzovesamicol]
Alternate Name(s) (2R,3R)-3-[4-(4-iodophenyl)-1-piperidinyl]-1,2,3,4-tetrahydronaphthalen-2-ol (2R,3R)-3-[4-(4-iodophenyl)-1-piperidyl]tetralin-2-ol (2R,3R)-3-[4-(4-iodophenyl)piperidin-1-yl]-1,2,3,4-tetrahydronaphthalen-2-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24INO
InChI InChI=1S/C21H24INO/c22-19-7-5-15(6-8-19)16-9-11-23(12-10-16)20-13-17-3-1-2-4-18(17)14-21(20)24/h1-8,16,20-21,24H,9-14H2/t20-,21-/m1/s1
InChIKey FDIYSOBTQZCZBV-NHCUHLMSSA-N
Molecular Weight 433.333 g/mol
SMILES O[C@]1([C@](N2CCC(c3ccc(cc3)I)CC2)(Cc2ccccc2C1)[H])[H]
SPLASH splash10-0kvo-9714200000-c25ff5746d2060ee8244
Source of Spectrum E1-39-3339-17
Wiley ID 1598913