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6-(2-Hydroxy-3-(4-(pyridin-2-yl)piperazin-1-yl)propoxy)-2-methyl-9H-xanthen-9-one
SpectraBase Compound ID 9d5ClaKS37M
InChI InChI=1S/C26H27N3O4/c1-18-5-8-23-22(14-18)26(31)21-7-6-20(15-24(21)33-23)32-17-19(30)16-28-10-12-29(13-11-28)25-4-2-3-9-27-25/h2-9,14-15,19,30H,10-13,16-17H2,1H3
InChIKey WOVDDTOIJFECNO-UHFFFAOYSA-N
Mol Weight 445.52 g/mol
Molecular Formula C26H27N3O4
Exact Mass 445.200156 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4EkRVEDTTk
Name 6-(2-Hydroxy-3-(4-(pyridin-2-yl)piperazin-1-yl)propoxy)-2-methyl-9H-xanthen-9-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H27N3O4
InChI InChI=1S/C26H27N3O4/c1-18-5-8-23-22(14-18)26(31)21-7-6-20(15-24(21)33-23)32-17-19(30)16-28-10-12-29(13-11-28)25-4-2-3-9-27-25/h2-9,14-15,19,30H,10-13,16-17H2,1H3
InChIKey WOVDDTOIJFECNO-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.200700156
Molecular Weight 445.519 g/mol
SMILES OC(COc1cc2Oc3ccc(cc3C(c2cc1)=O)C)CN1CCN(CC1)c1ccccn1
SPLASH splash10-056r-0910000000-0c00ec1a65f04751cf6e
Source of Spectrum APC-341-97-17
Synonyms 6-[2-hydroxy-3-[4-(2-pyridinyl)-1-piperazinyl]propoxy]-2-methyl-9-xanthenone 6-[2-hydroxy-3-(4-pyridin-2-ylpiperazin-1-yl)propoxy]-2-methylxanthen-9-one 6-[2-hydroxy-3-[4-(2-pyridyl)piperazin-1-yl]propoxy]-2-methyl-xanthen-9-one 2-Methyl-6-[2-oxidanyl-3-(4-pyridin-2-ylpiperazin-1-yl)propoxy]xanthen-9-one
Wiley ID 1768932