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3-butyn-2-ol, 4-[4-[[4-(3,4-dichlorophenyl)-1-piperazinyl]carbonyl]phenyl]-2-methyl-
SpectraBase Compound ID 7W5pzc7XUuq
InChI InChI=1S/C22H22Cl2N2O2/c1-22(2,28)10-9-16-3-5-17(6-4-16)21(27)26-13-11-25(12-14-26)18-7-8-19(23)20(24)15-18/h3-8,15,28H,11-14H2,1-2H3
InChIKey JADKDTLNJJVOSS-UHFFFAOYSA-N
Mol Weight 417.34 g/mol
Molecular Formula C22H22Cl2N2O2
Exact Mass 416.105833 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K31agyC5SE6
Name [4-(3,4-dichlorophenyl)-1-piperazinyl]-[4-(3-hydroxy-3-methylbut-1-ynyl)phenyl]methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22Cl2N2O2
InChI InChI=1S/C22H22Cl2N2O2/c1-22(2,28)10-9-16-3-5-17(6-4-16)21(27)26-13-11-25(12-14-26)18-7-8-19(23)20(24)15-18/h3-8,15,28H,11-14H2,1-2H3
InChIKey JADKDTLNJJVOSS-UHFFFAOYSA-N
Molecular Weight 417.336 g/mol
SMILES OC(C#Cc1ccc(C(N2CCN(CC2)c2cc(Cl)c(cc2)Cl)=O)cc1)(C)C
SPLASH splash10-0zfr-7970100000-d8030d5e8e9709059a9a
Synonyms [4-(3,4-dichlorophenyl)piperazin-1-yl]-[4-(3-hydroxy-3-methyl-but-1-ynyl)phenyl]methanone [4-(3,4-dichlorophenyl)piperazin-1-yl]-[4-(3-methyl-3-oxidanyl-but-1-ynyl)phenyl]methanone [4-(3,4-dichlorophenyl)piperazino]-[4-(3-hydroxy-3-methyl-but-1-ynyl)phenyl]methanone
Wiley ID 1455076