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1,1'-hexamethylenebis[4-benzylpiperazine], tetrahydrochloride, dihydrate

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1,1'-hexamethylenebis[4-benzylpiperazine], tetrahydrochloride, dihydrate
SpectraBase Compound ID 5FnTf6dFUn8
InChI InChI=1S/C30H46N4.4ClH.2H2O/c1(3-11-17-31-19-23-33(24-20-31)27-29-13-7-5-8-14-29)2-4-12-18-32-21-25-34(26-22-32)28-30-15-9-6-10-16-30;;;;;;/h5-10,13-16H,1-4,11-12,17-28H2;4*1H;2*1H2
InChIKey HPGXIYPIDGBHET-UHFFFAOYSA-N
Mol Weight 644.6 g/mol
Molecular Formula C30H54Cl4N4O2
Exact Mass 642.300088 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5Atzk7nWSNa
Name 1,1'-hexamethylenebis[4-benzylpiperazine], tetrahydrochloride, dihydrate
Source of Sample S. CHIAVARELLI, UNIVERSITY OF ROME, ROME, ITALY
Copyright Copyright © 2009-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H53Cl3N4O2
InChI InChI=1S/C30H46N4.4ClH.2H2O/c1(3-11-17-31-19-23-33(24-20-31)27-29-13-7-5-8-14-29)2-4-12-18-32-21-25-34(26-22-32)28-30-15-9-6-10-16-30;;;;;;/h5-10,13-16H,1-4,11-12,17-28H2;4*1H;2*1H2
InChIKey HPGXIYPIDGBHET-UHFFFAOYSA-N
Instrument Name Varian A-60
Literature Reference Abstract-Chemical Abstracts= 63, 8362(1965)
Sadtler NMR Number 5644M
Solvent D2O
Synonyms PIPERAZINE, 1,1*-HEXAMETHYLENEBIS- /4-BENZYL-, TETRAHYDROCHLORIDE, DI- HYDRATE