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(+-)-trans-2-Hydroxy-8-amino-5-iodo-3-(4-phenylpiperidino)tetralin [(+-)-8-amino-5-iodobenzovesamicol]
SpectraBase Compound ID 31R1tTwkSPl
InChI InChI=1S/C21H25IN2O/c22-18-6-7-19(23)17-13-21(25)20(12-16(17)18)24-10-8-15(9-11-24)14-4-2-1-3-5-14/h1-7,15,20-21,25H,8-13,23H2/t20-,21-/m1/s1
InChIKey OFBTWHNLURRFLU-NHCUHLMSSA-N
Mol Weight 448.35 g/mol
Molecular Formula C21H25IN2O
Exact Mass 448.101158 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IruQGOsDdWO
Name (+-)-trans-2-Hydroxy-8-amino-5-iodo-3-(4-phenylpiperidino)tetralin [(+-)-8-amino-5-iodobenzovesamicol]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25IN2O
InChI InChI=1S/C21H25IN2O/c22-18-6-7-19(23)17-13-21(25)20(12-16(17)18)24-10-8-15(9-11-24)14-4-2-1-3-5-14/h1-7,15,20-21,25H,8-13,23H2/t20-,21-/m1/s1
InChIKey OFBTWHNLURRFLU-NHCUHLMSSA-N
Molecular Weight 448.348 g/mol
SMILES O[C@]1([C@@](Cc2c(c(ccc2I)N)C1)(N1CCC(CC1)c1ccccc1)[H])[H]
SPLASH splash10-08fu-3920000000-eec02e9f6e95080bd089
Source of Spectrum E1-39-3338-4
Synonyms (2R,3R)-8-amino-5-iodo-3-(4-phenyl-1-piperidinyl)-1,2,3,4-tetrahydronaphthalen-2-ol (2R,3R)-8-amino-5-iodo-3-(4-phenylpiperidin-1-yl)-1,2,3,4-tetrahydronaphthalen-2-ol (2R,3R)-8-amino-5-iodo-3-(4-phenyl-1-piperidyl)tetralin-2-ol (2R,3R)-8-azanyl-5-iodanyl-3-(4-phenylpiperidin-1-yl)-1,2,3,4-tetrahydronaphthalen-2-ol
Wiley ID 1598924