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(1-Ferrocenylheptyl)-[2'-(methoxymethyl)-1'-pyrrolidinyl]amine
SpectraBase Compound ID GNpZN4Ay6F0
InChI InChI=1S/C18H31N2O.C5H5.Fe/c1-3-4-5-6-13-18(16-10-7-8-11-16)19-20-14-9-12-17(20)15-21-2;1-2-4-5-3-1;/h7-8,10-11,17-19H,3-6,9,12-15H2,1-2H3;1-5H;
InChIKey SIUIDBFVBOVGNB-UHFFFAOYSA-N
Mol Weight 412.4 g/mol
Molecular Formula C23H36FeN2O
Exact Mass 412.2177 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HqME7dFSLvx
Name (1-Ferrocenylheptyl)-[2'-(methoxymethyl)-1'-pyrrolidinyl]amine
Alternate Name(s) N-[1-(1-{1-ferrapentacyclo[2.2.0.0(1,3).0(1,5).0(2,6)]hexan-1-yl}cyclopenta-2,4-dien-1-yl)heptyl]-2-(methoxymethyl)pyrrolidin-1-amine
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H36FeN2O
InChI InChI=1S/C18H31N2O.C5H5.Fe/c1-3-4-5-6-13-18(16-10-7-8-11-16)19-20-14-9-12-17(20)15-21-2;1-2-4-5-3-1;/h7-8,10-11,17-19H,3-6,9,12-15H2,1-2H3;1-5H;
InChIKey SIUIDBFVBOVGNB-UHFFFAOYSA-N
Molecular Weight 412.399 g/mol
SMILES N(N1C(COC)CCC1)C(C1([Fe]2345C6C5[C@]4([C@]2(C36)[H])[H])C=CC=C1)CCCCCC
SPLASH splash10-001i-0090100000-afb45d0c7b6e72747311
Source of Spectrum U1-1998-693-3
Wiley ID 751113