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Meclofenoxate
SpectraBase Compound ID G97peJW41f8
InChI InChI=1S/C12H16ClNO3/c1-14(2)7-8-16-12(15)9-17-11-5-3-10(13)4-6-11/h3-6H,7-9H2,1-2H3
InChIKey XZTYGFHCIAKPGJ-UHFFFAOYSA-N
Mol Weight 257.72 g/mol
Molecular Formula C12H16ClNO3
Exact Mass 257.081871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JJSA5cQTGQy
Name Meclofenoxate
CAS Registry Number 51-68-3
Classification Pharmaceutical drug, cholinomimetic, anti-morbus Alzheimer
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 257.081871076 u
Formula C12H16ClNO3
InChI InChI=1S/C12H16ClNO3/c1-14(2)7-8-16-12(15)9-17-11-5-3-10(13)4-6-11/h3-6H,7-9H2,1-2H3
InChIKey XZTYGFHCIAKPGJ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 257.717 g/mol
Nominal Mass 257 u
Quality 895
Retention Index 1770
SMILES C1(OCC(OCCN(C)C)=O)=CC=C(C=C1)Cl
SPLASH splash10-0a4i-9100000000-d7e891073fb9fee3f02c
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Centrophenoxine 2-Dimethylaminoethyl-2-(4-chlorophenoxy)acetate
Technique GC/MS
Wiley ID DD2024_007860