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LR-5182
SpectraBase Compound ID A546YqrCJlh
InChI InChI=1S/C17H23Cl2N/c1-20(2)10-14-11-3-5-12(6-4-11)17(14)13-7-8-15(18)16(19)9-13/h7-9,11-12,14,17H,3-6,10H2,1-2H3/t11-,12+,14-,17-/m0/s1
InChIKey JOQQHMGSIKNGAF-IFOZYUSPSA-N
Mol Weight 312.28 g/mol
Molecular Formula C17H23Cl2N
Exact Mass 311.120755 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DnVQJYrtgwq
Name LR-5182
CAS Registry Number 62373-97-1
Classification Norepinephrine-dopamine reuptake inhibitor, Central stimulant
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 311.120755145 u
Formula C17H23Cl2N
InChI InChI=1S/C17H23Cl2N/c1-20(2)10-14-11-3-5-12(6-4-11)17(14)13-7-8-15(18)16(19)9-13/h7-9,11-12,14,17H,3-6,10H2,1-2H3/t11-,12+,14-,17-/m0/s1
InChIKey JOQQHMGSIKNGAF-IFOZYUSPSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 312.284 g/mol
Nominal Mass 311 u
Quality 995
Retention Index 2296
SMILES [C@]1([C@]([C@]2(CC[C@@]1(CC2)[H])[H])(CN(C)C)[H])(C1=CC(=C(C=C1)Cl)Cl)[H]
SPLASH splash10-0a4i-9801000000-6d3d0ce4bb0541e2653d
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-(3-(3,4-Dichlorophenyl)bicyclo[2.2.2]octan-2-yl)-N,N-dimethylmethanamine
Technique GC/MS
Wiley ID DD2024_018686