1,1',1'',1''',1'''',1''''-[2,2'-(p-phenylenedimethylene)di-S-phenenyl]hexapyrrolidine

SpectraBase Compound ID	2kbffEXBpVq
InChI	InChI=1S/C44H60N6/c1-2-18-45(17-1)37-31-41(47-21-5-6-22-47)39(42(32-37)48-23-7-8-24-48)29-35-13-15-36(16-14-35)30-40-43(49-25-9-10-26-49)33-38(46-19-3-4-20-46)34-44(40)50-27-11-12-28-50/h13-16,31-34H,1-12,17-30H2
InChIKey	XVDSRILIIVICTL-UHFFFAOYSA-N Google Search
Mol Weight	673.0 g/mol
Molecular Formula	C44H60N6
Exact Mass	672.487946 g/mol

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SpectraBase Spectrum ID	MZk79O2OT7
Name	1,1',1'',1''',1'''',1''''-[2,2'-(p-phenylenedimethylene)di-S-phenenyl]hexapyrrolidine
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	672.487945956 u
Formula	C44H60N6
InChI	InChI=1S/C44H60N6/c1-2-18-45(17-1)37-31-41(47-21-5-6-22-47)39(42(32-37)48-23-7-8-24-48)29-35-13-15-36(16-14-35)30-40-43(49-25-9-10-26-49)33-38(46-19-3-4-20-46)34-44(40)50-27-11-12-28-50/h13-16,31-34H,1-12,17-30H2
InChIKey	XVDSRILIIVICTL-UHFFFAOYSA-N
Molecular Weight	673.006 g/mol
SMILES	C=1C(=CC=C(C1)CC=1C(=CC(=CC1N1CCCC1)N1CCCC1)N1CCCC1)CC=1C(=CC(=CC1N1CCCC1)N1CCCC1)N1CCCC1