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[3-(2-phenylethynyl)phenyl]-(4-piperonylpiperazino)methanone
SpectraBase Compound ID 4MJc4bHfMI9
InChI InChI=1S/C27H24N2O3/c30-27(24-8-4-7-22(17-24)10-9-21-5-2-1-3-6-21)29-15-13-28(14-16-29)19-23-11-12-25-26(18-23)32-20-31-25/h1-8,11-12,17-18H,13-16,19-20H2
InChIKey YTPNXUIMBBTMAW-UHFFFAOYSA-N
Mol Weight 424.5 g/mol
Molecular Formula C27H24N2O3
Exact Mass 424.178693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6tmm01wCsEr
Name [3-(2-phenylethynyl)phenyl]-(4-piperonylpiperazino)methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H24N2O3
InChI InChI=1S/C27H24N2O3/c30-27(24-8-4-7-22(17-24)10-9-21-5-2-1-3-6-21)29-15-13-28(14-16-29)19-23-11-12-25-26(18-23)32-20-31-25/h1-8,11-12,17-18H,13-16,19-20H2
InChIKey YTPNXUIMBBTMAW-UHFFFAOYSA-N
Molecular Weight 424.500 g/mol
SMILES C(N1CCN(CC1)Cc1cc2OCOc2cc1)(c1cc(C#Cc2ccccc2)ccc1)=O
SPLASH splash10-002r-5920000000-fee96cc70ee9f4d986aa
Synonyms [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-[3-(2-phenylethynyl)phenyl]methanone [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[3-(2-phenylethynyl)phenyl]methanone
Wiley ID 1446183