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1,4-Bis((1-cyclohexyl-1H-tetrazol-5-yl)(p-tolyl)methyl)piperazine
SpectraBase Compound ID 94i1puIUIbr
InChI InChI=1S/C34H46N10/c1-25-13-17-27(18-14-25)31(33-35-37-39-43(33)29-9-5-3-6-10-29)41-21-23-42(24-22-41)32(28-19-15-26(2)16-20-28)34-36-38-40-44(34)30-11-7-4-8-12-30/h13-20,29-32H,3-12,21-24H2,1-2H3
InChIKey WSGYFVBDGZRKOI-UHFFFAOYSA-N
Mol Weight 594.8 g/mol
Molecular Formula C34H46N10
Exact Mass 594.390692 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7CxW5khcQuO
Name 1,4-Bis((1-cyclohexyl-1H-tetrazol-5-yl)(p-tolyl)methyl)piperazine
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H46N10
InChI InChI=1S/C34H46N10/c1-25-13-17-27(18-14-25)31(33-35-37-39-43(33)29-9-5-3-6-10-29)41-21-23-42(24-22-41)32(28-19-15-26(2)16-20-28)34-36-38-40-44(34)30-11-7-4-8-12-30/h13-20,29-32H,3-12,21-24H2,1-2H3
InChIKey WSGYFVBDGZRKOI-UHFFFAOYSA-N
Instrument Name HP 5937
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2720
Molecular Weight 594.812 g/mol
SMILES C1(CCCCC1)[n]1nnnc1C(c1ccc(cc1)C)N1CCN(CC1)C(c1ccc(C)cc1)c1[n](C2CCCCC2)nnn1
SPLASH splash10-0a5i-4942000000-1dfa5334afc333696cf6
Source of Spectrum Y-54-1399-3b
Wiley ID 1878203