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3,4-Dihydro-N-[4-(4-(2-pyridyl)piperazin-1-yl)butyl]isoquinolin-1(2H)-one
SpectraBase Compound ID C1HSE9acAsB
InChI InChI=1S/C22H28N4O/c27-22-20-8-2-1-7-19(20)10-14-26(22)13-6-5-12-24-15-17-25(18-16-24)21-9-3-4-11-23-21/h1-4,7-9,11H,5-6,10,12-18H2
InChIKey QPPNZGHQAPFXOG-UHFFFAOYSA-N
Mol Weight 364.49 g/mol
Molecular Formula C22H28N4O
Exact Mass 364.226312 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HC5q3vKGySq
Name 3,4-Dihydro-N-[4-(4-(2-pyridyl)piperazin-1-yl)butyl]isoquinolin-1(2H)-one
Alternate Name(s) 2-(4-(4-(pyridin-2-yl)piperazin-1-yl)butyl)-3,4-dihydroisoquinolin-1(2H)-one 2-[4-[4-(2-pyridinyl)-1-piperazinyl]butyl]-3,4-dihydroisoquinolin-1-one 2-[4-[4-(2-pyridyl)piperazin-1-yl]butyl]-3,4-dihydroisoquinolin-1-one 2-[4-(4-pyridin-2-ylpiperazin-1-yl)butyl]-3,4-dihydroisoquinolin-1-one
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Formula C22H28N4O
InChI InChI=1S/C22H28N4O/c27-22-20-8-2-1-7-19(20)10-14-26(22)13-6-5-12-24-15-17-25(18-16-24)21-9-3-4-11-23-21/h1-4,7-9,11H,5-6,10,12-18H2
InChIKey QPPNZGHQAPFXOG-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cmdc.201000101
Molecular Weight 364.493 g/mol
SMILES C1(N(CCc2ccccc12)CCCCN1CCN(CC1)c1ccccn1)=O
SPLASH splash10-0a4i-0960000000-6ee42fbffdfd8511490d
Source of Spectrum CMC-5-1313-12c
Wiley ID 1771716