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1-[6-[(6-chloranyl-2-methoxy-acridin-9-yl)amino]hexyl]-5-methyl-pyrimidine-2,4-dione
SpectraBase Compound ID BEYvC6mdz7H
InChI InChI=1S/C25H27ClN4O3/c1-16-15-30(25(32)29-24(16)31)12-6-4-3-5-11-27-23-19-9-7-17(26)13-22(19)28-21-10-8-18(33-2)14-20(21)23/h7-10,13-15H,3-6,11-12H2,1-2H3,(H,27,28)(H,29,31,32)
InChIKey GMSSHJFYHRVAOK-UHFFFAOYSA-N
Mol Weight 466.97 g/mol
Molecular Formula C25H27ClN4O3
Exact Mass 466.177168 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HGSAz2SNLJO
Name 1-[6-[(6-chloranyl-2-methoxy-acridin-9-yl)amino]hexyl]-5-methyl-pyrimidine-2,4-dione
CAS Registry Number 103061-91-2
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H27ClN4O3
InChI InChI=1S/C25H27ClN4O3/c1-16-15-30(25(32)29-24(16)31)12-6-4-3-5-11-27-23-19-9-7-17(26)13-22(19)28-21-10-8-18(33-2)14-20(21)23/h7-10,13-15H,3-6,11-12H2,1-2H3,(H,27,28)(H,29,31,32)
InChIKey GMSSHJFYHRVAOK-UHFFFAOYSA-N
Molecular Weight 466.969 g/mol
SMILES N1C(C(=CN(CCCCCCNc2c3c(ccc(c3)OC)nc3c2ccc(Cl)c3)C1=O)C)=O
SPLASH splash10-0160-0000900000-73ada4af0014d6e032ab
Source of Spectrum Y-22-1039-4
Synonyms 1-[6-[(6-chloro-2-methoxy-9-acridinyl)amino]hexyl]-5-methylpyrimidine-2,4-dione 1-[6-[(6-chloro-2-methoxy-acridin-9-yl)amino]hexyl]-5-methyl-pyrimidine-2,4-dione 1-[6-[(6-chloro-2-methoxy-acridin-9-yl)amino]hexyl]-5-methyl-pyrimidine-2,4-quinone
Wiley ID 1391936