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Dihexyverine

View entire compound with spectra: 1 MS (GC)

Dihexyverine
SpectraBase Compound ID ITjASuulRlJ
InChI InChI=1S/C20H35NO2/c22-19(23-17-16-21-14-8-3-9-15-21)20(12-6-2-7-13-20)18-10-4-1-5-11-18/h18H,1-17H2
InChIKey MNSQDVCVWNXBFQ-UHFFFAOYSA-N
Mol Weight 321.5 g/mol
Molecular Formula C20H35NO2
Exact Mass 321.266779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IFCGJsDRWTS
Name Dihexyverine
CAS Registry Number 561-77-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H35NO2
InChI InChI=1S/C20H35NO2/c22-19(23-17-16-21-14-8-3-9-15-21)20(12-6-2-7-13-20)18-10-4-1-5-11-18/h18H,1-17H2
InChIKey MNSQDVCVWNXBFQ-UHFFFAOYSA-N
Molecular Weight 321.505 g/mol
SMILES C1CCC(CC1)C1(CCCCC1)C(=O)OCCN1CCCCC1
SPLASH splash10-0002-9300000000-2d8300c51cc680f6f434
Source of Spectrum JZ-1992-2061-0
Synonyms (bicyclohexyl)-1-carboxylic acid, 2-piperidinoethyl ester 1-cyclohexyl-1-cyclohexanecarboxylic acid 2-(1-piperidinyl)ethyl ester 1-cyclohexylcyclohexanecarboxylic acid 2-piperidinoethyl ester 2-(1-piperidyl)ethyl 1-cyclohexylcyclohexanecarboxylate 2-Piperidinoethyl ester of bicyclohexyl-1-carboxylic acid Dihexiverina Dihexiverine Dihexyverinum Metaspas Spasmalex Spasmodex Spasmolevel BRN 0247822
Wiley ID 1321083