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4-(2-Hydroxy-3-(4-(2-phenoxyethyl)piperazin-1-yl)propoxy)-9H-xanthen-9-one
SpectraBase Compound ID 6kEdAdpGZ8e
InChI InChI=1S/C28H30N2O5/c31-21(19-30-15-13-29(14-16-30)17-18-33-22-7-2-1-3-8-22)20-34-26-12-6-10-24-27(32)23-9-4-5-11-25(23)35-28(24)26/h1-12,21,31H,13-20H2
InChIKey LXLDFNFBWAKCBE-UHFFFAOYSA-N
Mol Weight 474.56 g/mol
Molecular Formula C28H30N2O5
Exact Mass 474.215472 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ATlP6jsqHL
Name 4-(2-Hydroxy-3-(4-(2-phenoxyethyl)piperazin-1-yl)propoxy)-9H-xanthen-9-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H30N2O5
InChI InChI=1S/C28H30N2O5/c31-21(19-30-15-13-29(14-16-30)17-18-33-22-7-2-1-3-8-22)20-34-26-12-6-10-24-27(32)23-9-4-5-11-25(23)35-28(24)26/h1-12,21,31H,13-20H2
InChIKey LXLDFNFBWAKCBE-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.200700156
Molecular Weight 474.557 g/mol
SMILES OC(COc1cccc2C(c3ccccc3Oc12)=O)CN1CCN(CC1)CCOc1ccccc1
SPLASH splash10-014i-2094000000-87e927a9d2d30f3f121e
Source of Spectrum APC-341-96-12
Synonyms 4-[2-hydroxy-3-[4-(2-phenoxyethyl)-1-piperazinyl]propoxy]-9-xanthenone 4-[2-hydroxy-3-[4-(2-phenoxyethyl)piperazin-1-yl]propoxy]xanthen-9-one 4-[2-oxidanyl-3-[4-(2-phenoxyethyl)piperazin-1-yl]propoxy]xanthen-9-one
Wiley ID 1768928