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Loperamid-A
SpectraBase Compound ID Cf6RooezSE4
InChI InChI=1S/C26H24ClNO/c27-24-13-11-23(12-14-24)26(29)16-19-28(20-17-26)18-15-25(21-7-3-1-4-8-21)22-9-5-2-6-10-22/h1-16,19,29H,17-18,20H2
InChIKey YTTUARZGRRVOKH-UHFFFAOYSA-N
Mol Weight 401.94 g/mol
Molecular Formula C26H24ClNO
Exact Mass 401.154642 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Idp1wcnm3k
Name Loperamid-A
Classification Pharmaceutical drug artifact
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 401.154642096 u
Formula C26H24ClNO
InChI InChI=1S/C26H24ClNO/c27-24-13-11-23(12-14-24)26(29)16-19-28(20-17-26)18-15-25(21-7-3-1-4-8-21)22-9-5-2-6-10-22/h1-16,19,29H,17-18,20H2
InChIKey YTTUARZGRRVOKH-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 401.937 g/mol
Nominal Mass 401 u
Quality 945
Retention Index 3064
SMILES OC1(C=2C=CC(=CC2)Cl)C=CN(CC1)CC=C(C1=CC=CC=C1)C1=CC=CC=C1
SPLASH splash10-000i-2980000000-177df45bdbda1acefb00
Sample Comments Structure uncertain
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-(4-chlorophenyl)-1-(3,3-diphenylprop-2-en-1-yl)-1,2,3,4-tetrahydropyridin-4-ol
Technique GC/MS
Wiley ID DD2024_001853