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2-{[4-(2-hydroxy-5-nitrobenzyl)-1-piperazinyl]methyl}-4-nitrophenol
SpectraBase Compound ID Go4R1pEs6fq
InChI InChI=1S/C18H20N4O6/c23-17-3-1-15(21(25)26)9-13(17)11-19-5-7-20(8-6-19)12-14-10-16(22(27)28)2-4-18(14)24/h1-4,9-10,23-24H,5-8,11-12H2
InChIKey ZXJWFZZSBCGLOX-UHFFFAOYSA-N
Mol Weight 388.38 g/mol
Molecular Formula C18H20N4O6
Exact Mass 388.138284 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzntOiP2Lzr
Name
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H20N4O6
InChI InChI=1S/C18H20N4O6/c23-17-3-1-15(21(25)26)9-13(17)11-19-5-7-20(8-6-19)12-14-10-16(22(27)28)2-4-18(14)24/h1-4,9-10,23-24H,5-8,11-12H2
InChIKey ZXJWFZZSBCGLOX-UHFFFAOYSA-N
Molecular Weight 388.1378
SMILES Oc1ccc(cc1CN1CCN(Cc2c(O)ccc(c2)N(=O)=O)CC1)N(=O)=O
SPLASH splash10-052o-9310000000-a40feac0d980d84844e1
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany