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4-(4'-(4"-Chlorophenyl)-4'-hydroxypiperidinyl)-1-m-biphenylbut-2-yn-1-one
SpectraBase Compound ID 2OhA0dyojIy
InChI InChI=1S/C27H24ClNO2/c28-24-11-9-23(10-12-24)27(31)15-17-29(18-16-27)25-13-14-26(21-6-2-1-3-7-21)22(20-25)8-4-5-19-30/h1-3,6-7,9-14,19-20,31H,8,15-18H2
InChIKey IORVIOAJSSHSBJ-UHFFFAOYSA-N
Mol Weight 429.95 g/mol
Molecular Formula C27H24ClNO2
Exact Mass 429.149557 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cm6CQl4z2IC
Name 4-(4'-(4"-Chlorophenyl)-4'-hydroxypiperidinyl)-1-m-biphenylbut-2-yn-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H24ClNO2
InChI InChI=1S/C27H24ClNO2/c28-24-11-9-23(10-12-24)27(31)15-17-29(18-16-27)25-13-14-26(21-6-2-1-3-7-21)22(20-25)8-4-5-19-30/h1-3,6-7,9-14,19-20,31H,8,15-18H2
InChIKey IORVIOAJSSHSBJ-UHFFFAOYSA-N
Molecular Weight 429.947 g/mol
SMILES OC1(CCN(c2cc(CC#CC=O)c(cc2)-c2ccccc2)CC1)c1ccc(cc1)Cl
SPLASH splash10-0f89-2930300000-4d7ad603b3d0636f386e
Source of Spectrum E1-37-670-5
Synonyms 4-{4-[4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl][1,1'-biphenyl]-2-yl}-2-butynal 4-[5-[4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl]-2-phenylphenyl]-2-butynal 4-[5-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-phenylphenyl]but-2-ynal 4-[5-[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]-2-phenyl-phenyl]but-2-ynal 4-[5-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-2-phenyl-phenyl]but-2-ynal
Wiley ID 1574915