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2-{4-(p-CHLOROPHENYL)-4-(3-PIPERIDINOPROPOXY)PIPERIDINO]-6'-METHYL-o-ACETOTOLUIDIDE, DIOXALATE
SpectraBase Compound ID J2SeRq4b0Iz
InChI InChI=1S/C29H40ClN3O2.2C2H2O4/c1-23-8-6-9-24(2)28(23)31-27(34)22-33-19-14-29(15-20-33,25-10-12-26(30)13-11-25)35-21-7-18-32-16-4-3-5-17-32;2*3-1(4)2(5)6/h6,8-13H,3-5,7,14-22H2,1-2H3,(H,31,34);2*(H,3,4)(H,5,6)
InChIKey CPVVBNTZUWSZDN-UHFFFAOYSA-N
Mol Weight 678.2 g/mol
Molecular Formula C33H44ClN3O10
Exact Mass 677.271522 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 6MSXPkQuzGr
Name 2-{4-(p-CHLOROPHENYL)-4-(3-PIPERIDINOPROPOXY)PIPERIDINO]-6'-METHYL-o-ACETOTOLUIDIDE, DIOXALATE
Source of Sample B. Hermans, Janssen Pharmaceutica, Beerse, Belgium
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H44ClN3O10
InChI InChI=1S/C29H40ClN3O2.2C2H2O4/c1-23-8-6-9-24(2)28(23)31-27(34)22-33-19-14-29(15-20-33,25-10-12-26(30)13-11-25)35-21-7-18-32-16-4-3-5-17-32;2*3-1(4)2(5)6/h6,8-13H,3-5,7,14-22H2,1-2H3,(H,31,34);2*(H,3,4)(H,5,6)
InChIKey CPVVBNTZUWSZDN-UHFFFAOYSA-N
Literature Reference JMCH 13, 835(1970)
Melting Point 161-181C (dec.)
Molecular Weight 678.176025
Synonyms O-ACETOTOLUIDIDE, 2-/4-/P-CHLORO- PHENYL/-4-/3-PIPERIDINOPROPOXY/- PIPERIDINO/-6*-METHYL-, DIOXALATE
Technique KBr WAFER